[[4-[(3-oxidanylnaphthalen-2-yl)carbonyldiazenyl]phenyl]amino] 3,4-dimethoxybenzoate

Systemtic Name: [[4-[(3-oxidanylnaphthalen-2-yl)carbonyldiazenyl]phenyl]amino] 3,4-dimethoxybenzoate Openeye Name: [4-(3-hydroxynaphthalene-2-carbonyl)azoanilino] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-[(3-hydroxy-2-naphthalenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3-hydroxynaphthalene-2-carbonyl)diazenyl]anilino] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-(3-hydroxy-2-naphthoyl)azoanilino] ester Formula: C26H21N3O6 MolecularWeight: 471.46144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC4=CC=CC=C4C=C3O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC4=CC=CC=C4C=C3O)OC

InChI

InChI=1S/C26H21N3O6/c1-33-23-12-7-18(15-24(23)34-2)26(32)35-29-20-10-8-19(9-11-20)27-28-25(31)21-13-16-5-3-4-6-17(16)14-22(21)30/h3-15,29-30H,1-2H3