2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate

C270H324N12O12 — CID 163471550

About 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate

2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate (PubChem CID 163471550) has the molecular formula C270H324N12O12 and a molecular weight of 3929.63 g/mol. Its IUPAC name is 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate.

Molecular Properties

• Compound Name: 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate
• PubChem CID: 163471550
• Molecular Formula: C270H324N12O12
• Molecular Weight: 3929.63 g/mol
• Exact Mass: 3926.51
• IUPAC Name: 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate
• SMILES: CCCCC(CC)CN(c1ccc(C)cc1)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4ccc(C)cc4)C=C3)C2=O)cc1.CCCCC(CC)CN(c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4c(C)cc(C)cc4C)C=C3)C2=O)cc1)c1c(C)cc(C)cc1C.CCCCC(CC)CN(c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4ccc(C)cc4C)C=C3)C2=O)cc1)c1ccc(C)cc1C.Cc1ccc(N(CC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1.Cc1ccc(N(CCC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CCC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1.Cc1ccc(N(CCCC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CCCC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1
• InChI: InChI=1S/C50H64N2O2.C48H60N2O2.C46H56N2O2.C44H52N2O2.C42H48N2O2.C40H44N2O2/c1-11-15-17-39(13-3)31-51(47-35(7)27-33(5)28-36(47)8)43-23-19-41(20-24-43)45-49(53)46(50(45)54)42-21-25-44(26-22-42)52(32-40(14-4)18-16-12-2)48-37(9)29-34(6)30-38(48)10;1-9-13-15-37(11-3)31-49(43-27-17-33(5)29-35(43)7)41-23-19-39(20-24-41)45-47(51)46(48(45)52)40-21-25-42(26-22-40)50(32-38(12-4)16-14-10-2)44-28-18-34(6)30-36(44)8;1-7-11-13-35(9-3)31-47(39-23-15-33(5)16-24-39)41-27-19-37(20-28-41)43-45(49)44(46(43)50)38-21-29-42(30-22-38)48(32-36(10-4)14-12-8-2)40-25-17-34(6)18-26-40;1-29(2)11-9-25-45(39-23-13-31(5)27-33(39)7)37-19-15-35(16-20-37)41-43(47)42(44(41)48)36-17-21-38(22-18-36)46(26-10-12-30(3)4)40-24-14-32(6)28-34(40)8;1-27(2)21-23-43(37-19-9-29(5)25-31(37)7)35-15-11-33(12-16-35)39-41(45)40(42(39)46)34-13-17-36(18-14-34)44(24-22-28(3)4)38-20-10-30(6)26-32(38)8;1-25(2)23-41(35-19-9-27(5)21-29(35)7)33-15-11-31(12-16-33)37-39(43)38(40(37)44)32-13-17-34(18-14-32)42(24-26(3)4)36-20-10-28(6)22-30(36)8/h19-30,39-40H,11-18,31-32H2,1-10H3;17-30,37-38H,9-16,31-32H2,1-8H3;15-30,35-36H,7-14,31-32H2,1-6H3;13-24,27-30H,9-12,25-26H2,1-8H3;9-20,25-28H,21-24H2,1-8H3;9-22,25-26H,23-24H2,1-8H3
• InChIKey: BWYMCSTWGDBVMM-UHFFFAOYSA-N
• XLogP: 61.10
• TPSA: 278.28 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 78
• Heavy Atoms: 294
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3929.63
LogP ≤ 5	61.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate?

The IUPAC name of 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate (CID 163471550) is 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate.

What is the SMILES notation for 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate?

The canonical SMILES for 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate is CCCCC(CC)CN(c1ccc(C)cc1)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4ccc(C)cc4)C=C3)C2=O)cc1.CCCCC(CC)CN(c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4c(C)cc(C)cc4C)C=C3)C2=O)cc1)c1c(C)cc(C)cc1C.CCCCC(CC)CN(c1ccc(C2=C([O-])C(=C3C=CC(=[N+](CC(CC)CCCC)c4ccc(C)cc4C)C=C3)C2=O)cc1)c1ccc(C)cc1C.Cc1ccc(N(CC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1.Cc1ccc(N(CCC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CCC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1.Cc1ccc(N(CCCC(C)C)c2ccc(C3=C([O-])C(=C4C=CC(=[N+](CCCC(C)C)c5ccc(C)cc5C)C=C4)C3=O)cc2)c(C)c1.

What is the InChIKey of 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate?

The InChIKey is BWYMCSTWGDBVMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H64N2O2.C48H60N2O2.C46H56N2O2.C44H52N2O2.C42H48N2O2.C40H44N2O2/c1-11-15-17-39(13-3)31-51(47-35(7)27-33(5)28-36(47)8)43-23-19-41(20-24-43)45-49(53)46(50(45)54)42-21-25-44(26-22-42)52(32-40(14-4)18-16-12-2)48-37(9)29-34(6)30-38(48)10;1-9-13-15-37(11-3)31-49(43-27-17-33(5)29-35(43)7)41-23-19-39(20-24-41)45-47(51)46(48(45)52)40-21-25-42(26-22-40)50(32-38(12-4)16-14-10-2)44-28-18-34(6)30-36(44)8;1-7-11-13-35(9-3)31-47(39-23-15-33(5)16-24-39)41-27-19-37(20-28-41)43-45(49)44(46(43)50)38-21-29-42(30-22-38)48(32-36(10-4)14-12-8-2)40-25-17-34(6)18-26-40;1-29(2)11-9-25-45(39-23-13-31(5)27-33(39)7)37-19-15-35(16-20-37)41-43(47)42(44(41)48)36-17-21-38(22-18-36)46(26-10-12-30(3)4)40-24-14-32(6)28-34(40)8;1-27(2)21-23-43(37-19-9-29(5)25-31(37)7)35-15-11-33(12-16-35)39-41(45)40(42(39)46)34-13-17-36(18-14-34)44(24-22-28(3)4)38-20-10-30(6)26-32(38)8;1-25(2)23-41(35-19-9-27(5)21-29(35)7)33-15-11-31(12-16-33)37-39(43)38(40(37)44)32-13-17-34(18-14-32)42(24-26(3)4)36-20-10-28(6)22-30(36)8/h19-30,39-40H,11-18,31-32H2,1-10H3;17-30,37-38H,9-16,31-32H2,1-8H3;15-30,35-36H,7-14,31-32H2,1-6H3;13-24,27-30H,9-12,25-26H2,1-8H3;9-20,25-28H,21-24H2,1-8H3;9-22,25-26H,23-24H2,1-8H3.

What are the key properties of 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate?

2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate has a molecular weight of 3929.63 g/mol, XLogP of 61.10, 78 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[2,4-dimethyl-N-(3-methylbutyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(3-methylbutyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(4-methylpentyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(4-methylpentyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[2,4-dimethyl-N-(2-methylpropyl)anilino]phenyl]-4-[4-[(2,4-dimethylphenyl)-(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;4-[4-[(2,4-dimethylphenyl)-(2-ethylhexyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-[4-[N-(2-ethylhexyl)-2,4-dimethylanilino]phenyl]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-4-methylanilino]phenyl]-4-[4-[2-ethylhexyl-(4-methylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate;2-[4-[N-(2-ethylhexyl)-2,4,6-trimethylanilino]phenyl]-4-[4-[2-ethylhexyl-(2,4,6-trimethylphenyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-3-oxocyclobuten-1-olate is sourced from PubChem (CID 163471550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).