6-azanyl-1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methoxyphenyl)-2-oxo-quinoline-3-carboxylic acid CAS Name: 6-amino-1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methoxyphenyl)-2-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methoxyphenyl)-2-oxoquinoline-3-carboxylic acid Traditional Name: 6-amino-2-keto-4-(4-methoxyphenyl)-1-o-veratryl-quinoline-3-carboxylic acid Formula: C26H24N2O6 MolecularWeight: 460.47856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N(C3=C2C=C(C=C3)N)CC4=C(C(=CC=C4)OC)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N(C3=C2C=C(C=C3)N)CC4=C(C(=CC=C4)OC)OC)C(=O)O

InChI

InChI=1S/C26H24N2O6/c1-32-18-10-7-15(8-11-18)22-19-13-17(27)9-12-20(19)28(25(29)23(22)26(30)31)14-16-5-4-6-21(33-2)24(16)34-3/h4-13H,14,27H2,1-3H3,(H,30,31)