2-[[6-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-3,4-dihydroquinolin-1-yl]carbonyl]phenolate

Systemtic Name: 2-[[6-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-3,4-dihydroquinolin-1-yl]carbonyl]phenolate Openeye Name: 2-[6-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-2-oxo-3,4-dihydroquinoline-1-carbonyl]phenolate CAS Name: 2-[[6-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-2-oxo-3,4-dihydroquinolin-1-yl]-oxomethyl]phenolate IUPAC Name: 2-[6-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-2-oxo-3,4-dihydroquinoline-1-carbonyl]phenolate Traditional Name: 2-[2-keto-6-(4-veratroylpiperazino)-3,4-dihydroquinoline-1-carbonyl]phenolate Formula: C29H28N3O6- MolecularWeight: 514.54912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)C(=O)C5=CC=CC=C5[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)C(=O)C5=CC=CC=C5[O-])OC

InChI

InChI=1S/C29H29N3O6/c1-37-25-11-7-20(18-26(25)38-2)28(35)31-15-13-30(14-16-31)21-9-10-23-19(17-21)8-12-27(34)32(23)29(36)22-5-3-4-6-24(22)33/h3-7,9-11,17-18,33H,8,12-16H2,1-2H3/p-1