ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one

C143H164N6O28P2S — CID 161277847

About ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one

ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one (PubChem CID 161277847) has the molecular formula C143H164N6O28P2S and a molecular weight of 2508.91 g/mol. Its IUPAC name is ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one.

Molecular Properties

• Compound Name: ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one
• PubChem CID: 161277847
• Molecular Formula: C143H164N6O28P2S
• Molecular Weight: 2508.91 g/mol
• Exact Mass: 2507.08
• IUPAC Name: ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one
• SMILES: CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c(C)[nH]c13)CCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c[nH]c13)CCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c[nH]c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)cn(COP(=O)(O)O)c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)cn(COP(=O)(OC(C)(C)C)OC(C)(C)C)c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccsc4)c[nH]c13)CCCC2
• InChI: InChI=1S/C31H42NO8P.C24H27NO3.C23H26NO8P.C23H25NO3.C22H23NO4.C20H21NO2S/c1-9-16-36-25-18-22-11-10-17-37-29(22)26-27(25)32(19-24(28(26)33)21-12-14-23(35-8)15-13-21)20-38-41(34,39-30(2,3)4)40-31(5,6)7;1-4-13-28-20-14-17-7-5-6-8-19(17)22-23(20)25-15(2)21(24(22)26)16-9-11-18(27-3)12-10-16;1-3-10-30-19-12-16-5-4-11-31-23(16)20-21(19)24(14-32-33(26,27)28)13-18(22(20)25)15-6-8-17(29-2)9-7-15;1-3-12-27-20-13-16-6-4-5-7-18(16)21-22(20)24-14-19(23(21)25)15-8-10-17(26-2)11-9-15;1-3-10-26-18-12-15-5-4-11-27-22(15)19-20(18)23-13-17(21(19)24)14-6-8-16(25-2)9-7-14;1-2-8-23-17-10-13-5-3-4-6-15(13)18-19(17)21-11-16(20(18)22)14-7-9-24-12-14/h12-15,18-19H,9-11,16-17,20H2,1-8H3;9-12,14H,4-8,13H2,1-3H3,(H,25,26);6-9,12-13H,3-5,10-11,14H2,1-2H3,(H2,26,27,28);8-11,13-14H,3-7,12H2,1-2H3,(H,24,25);6-9,12-13H,3-5,10-11H2,1-2H3,(H,23,24);7,9-12H,2-6,8H2,1H3,(H,21,22)
• InChIKey: VERHGULMUHVDJW-UHFFFAOYSA-N
• XLogP: 30.65
• TPSA: 416.18 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 29
• Rotatable Bonds: 37
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2508.91
LogP ≤ 5	30.65
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one?

The IUPAC name of ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one (CID 161277847) is ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one.

What is the SMILES notation for ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one?

The canonical SMILES for ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one is CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c(C)[nH]c13)CCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c[nH]c13)CCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)c[nH]c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)cn(COP(=O)(O)O)c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccc(OC)cc4)cn(COP(=O)(OC(C)(C)C)OC(C)(C)C)c13)OCCC2.CCCOc1cc2c(c3c(=O)c(-c4ccsc4)c[nH]c13)CCCC2.

What is the InChIKey of ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one?

The InChIKey is VERHGULMUHVDJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H42NO8P.C24H27NO3.C23H26NO8P.C23H25NO3.C22H23NO4.C20H21NO2S/c1-9-16-36-25-18-22-11-10-17-37-29(22)26-27(25)32(19-24(28(26)33)21-12-14-23(35-8)15-13-21)20-38-41(34,39-30(2,3)4)40-31(5,6)7;1-4-13-28-20-14-17-7-5-6-8-19(17)22-23(20)25-15(2)21(24(22)26)16-9-11-18(27-3)12-10-16;1-3-10-30-19-12-16-5-4-11-31-23(16)20-21(19)24(14-32-33(26,27)28)13-18(22(20)25)15-6-8-17(29-2)9-7-15;1-3-12-27-20-13-16-6-4-5-7-18(16)21-22(20)24-14-19(23(21)25)15-8-10-17(26-2)11-9-15;1-3-10-26-18-12-15-5-4-11-27-22(15)19-20(18)23-13-17(21(19)24)14-6-8-16(25-2)9-7-14;1-2-8-23-17-10-13-5-3-4-6-15(13)18-19(17)21-11-16(20(18)22)14-7-9-24-12-14/h12-15,18-19H,9-11,16-17,20H2,1-8H3;9-12,14H,4-8,13H2,1-3H3,(H,25,26);6-9,12-13H,3-5,10-11,14H2,1-2H3,(H2,26,27,28);8-11,13-14H,3-7,12H2,1-2H3,(H,24,25);6-9,12-13H,3-5,10-11H2,1-2H3,(H,23,24);7,9-12H,2-6,8H2,1H3,(H,21,22).

What are the key properties of ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one?

ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one has a molecular weight of 2508.91 g/mol, XLogP of 30.65, 37 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for ditert-butyl [9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl phosphate;2-(4-methoxyphenyl)-3-methyl-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;[9-(4-methoxyphenyl)-10-oxo-6-propoxy-3,4-dihydro-2H-pyrano[2,3-f]quinolin-7-yl]methyl dihydrogen phosphate;2-(4-methoxyphenyl)-5-propoxy-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one;9-(4-methoxyphenyl)-6-propoxy-2,3,4,7-tetrahydropyrano[2,3-f]quinolin-10-one;5-propoxy-2-thiophen-3-yl-7,8,9,10-tetrahydro-4H-benzo[f]quinolin-1-one is sourced from PubChem (CID 161277847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).