7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide

C117H129BrCl4N2O22 — CID 158076884

About 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide

7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide (PubChem CID 158076884) has the molecular formula C117H129BrCl4N2O22 and a molecular weight of 2137.03 g/mol. Its IUPAC name is 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide.

Molecular Properties

• Compound Name: 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide
• PubChem CID: 158076884
• Molecular Formula: C117H129BrCl4N2O22
• Molecular Weight: 2137.03 g/mol
• Exact Mass: 2132.70
• IUPAC Name: 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide
• SMILES: Br.CC1(C(=O)NO)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.CC1(C(=O)NOC2CCCCO2)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.CC1(C(=O)O)CCc2ccc(O)cc2C1.CC1(C(=O)O)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.COC(=O)C1(C)CCc2ccc(O)cc2C1.COC(=O)C1(C)CCc2ccc(OC)cc2C1.COC(=O)C1(C)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1
• InChI: InChI=1S/C23H26ClNO4.C19H19ClO3.C18H18ClNO3.C18H17ClO3.C14H18O3.C13H16O3.C12H14O3.BrH/c1-23(22(26)25-29-21-4-2-3-13-27-21)12-11-16-5-8-20(14-17(16)15-23)28-19-9-6-18(24)7-10-19;1-19(18(21)22-2)10-9-13-3-6-17(11-14(13)12-19)23-16-7-4-15(20)5-8-16;1-18(17(21)20-22)9-8-12-2-5-16(10-13(12)11-18)23-15-6-3-14(19)4-7-15;1-18(17(20)21)9-8-12-2-5-16(10-13(12)11-18)22-15-6-3-14(19)4-7-15;1-14(13(15)17-3)7-6-10-4-5-12(16-2)8-11(10)9-14;1-13(12(15)16-2)6-5-9-3-4-11(14)7-10(9)8-13;1-12(11(14)15)5-4-8-2-3-10(13)6-9(8)7-12;/h5-10,14,21H,2-4,11-13,15H2,1H3,(H,25,26);3-8,11H,9-10,12H2,1-2H3;2-7,10,22H,8-9,11H2,1H3,(H,20,21);2-7,10H,8-9,11H2,1H3,(H,20,21);4-5,8H,6-7,9H2,1-3H3;3-4,7,14H,5-6,8H2,1-2H3;2-3,6,13H,4-5,7H2,1H3,(H,14,15);1H
• InChIKey: XFVTZGHEFPFHPT-UHFFFAOYSA-N
• XLogP: 25.82
• TPSA: 337.00 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 20
• Rotatable Bonds: 18
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2137.03
LogP ≤ 5	25.82
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide?

The IUPAC name of 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide (CID 158076884) is 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide.

What is the SMILES notation for 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide?

The canonical SMILES for 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide is Br.CC1(C(=O)NO)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.CC1(C(=O)NOC2CCCCO2)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.CC1(C(=O)O)CCc2ccc(O)cc2C1.CC1(C(=O)O)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.COC(=O)C1(C)CCc2ccc(O)cc2C1.COC(=O)C1(C)CCc2ccc(OC)cc2C1.COC(=O)C1(C)CCc2ccc(Oc3ccc(Cl)cc3)cc2C1.

What is the InChIKey of 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide?

The InChIKey is XFVTZGHEFPFHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26ClNO4.C19H19ClO3.C18H18ClNO3.C18H17ClO3.C14H18O3.C13H16O3.C12H14O3.BrH/c1-23(22(26)25-29-21-4-2-3-13-27-21)12-11-16-5-8-20(14-17(16)15-23)28-19-9-6-18(24)7-10-19;1-19(18(21)22-2)10-9-13-3-6-17(11-14(13)12-19)23-16-7-4-15(20)5-8-16;1-18(17(21)20-22)9-8-12-2-5-16(10-13(12)11-18)23-15-6-3-14(19)4-7-15;1-18(17(20)21)9-8-12-2-5-16(10-13(12)11-18)22-15-6-3-14(19)4-7-15;1-14(13(15)17-3)7-6-10-4-5-12(16-2)8-11(10)9-14;1-13(12(15)16-2)6-5-9-3-4-11(14)7-10(9)8-13;1-12(11(14)15)5-4-8-2-3-10(13)6-9(8)7-12;/h5-10,14,21H,2-4,11-13,15H2,1H3,(H,25,26);3-8,11H,9-10,12H2,1-2H3;2-7,10,22H,8-9,11H2,1H3,(H,20,21);2-7,10H,8-9,11H2,1H3,(H,20,21);4-5,8H,6-7,9H2,1-3H3;3-4,7,14H,5-6,8H2,1-2H3;2-3,6,13H,4-5,7H2,1H3,(H,14,15);1H.

What are the key properties of 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide?

7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide has a molecular weight of 2137.03 g/mol, XLogP of 25.82, 18 rotatable bonds, 7 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(4-chlorophenoxy)-N-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxamide;7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;7-(4-chlorophenoxy)-2-methyl-N-(oxan-2-yloxy)-3,4-dihydro-1H-naphthalene-2-carboxamide;7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid;methyl 7-(4-chlorophenoxy)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-hydroxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;methyl 7-methoxy-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylate;hydrobromide is sourced from PubChem (CID 158076884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).