ethyl 6-ethoxy-3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanylidene-quinoline-2-carboxylate

Systemtic Name: ethyl 6-ethoxy-3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanylidene-quinoline-2-carboxylate Openeye Name: ethyl 6-ethoxy-3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxo-quinoline-2-carboxylate CAS Name: 6-ethoxy-3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxo-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-ethoxy-3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxoquinoline-2-carboxylate Traditional Name: 3-(3-carbethoxybenzyl)-6-ethoxy-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-keto-quinaldic acid ethyl ester Formula: C34H35NO8 MolecularWeight: 585.6436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1CN3C4=C(C=C(C=C4)OCC)C(=O)C(=C3C(=O)OCC)CC5=CC=CC(=C5)C(=O)OCC)OCO2

Isomeric SMILES

CCC1=CC2=C(C=C1CN3C4=C(C=C(C=C4)OCC)C(=O)C(=C3C(=O)OCC)CC5=CC=CC(=C5)C(=O)OCC)OCO2

InChI

InChI=1S/C34H35NO8/c1-5-22-16-29-30(43-20-42-29)17-24(22)19-35-28-13-12-25(39-6-2)18-26(28)32(36)27(31(35)34(38)41-8-4)15-21-10-9-11-23(14-21)33(37)40-7-3/h9-14,16-18H,5-8,15,19-20H2,1-4H3