[5-(1,3-dimethylindol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] benzoate

Systemtic Name: [5-(1,3-dimethylindol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] benzoate Openeye Name: [5-(1,3-dimethylindol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxo-cyclohexen-1-yl] benzoate CAS Name: benzoic acid [5-(1,3-dimethyl-2-indolyl)-2-[(1Z)-1-ethoxyiminobutyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(1,3-dimethylindol-2-yl)-2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-3-oxocyclohexen-1-yl] benzoate Traditional Name: benzoic acid [5-(1,3-dimethylindol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-keto-cyclohexen-1-yl] ester Formula: C29H32N2O4 MolecularWeight: 472.57538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NOCC)C1=C(CC(CC1=O)C2=C(C3=CC=CC=C3N2C)C)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CCC/C(=N/OCC)/C1=C(CC(CC1=O)C2=C(C3=CC=CC=C3N2C)C)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O4/c1-5-12-23(30-34-6-2)27-25(32)17-21(18-26(27)35-29(33)20-13-8-7-9-14-20)28-19(3)22-15-10-11-16-24(22)31(28)4/h7-11,13-16,21H,5-6,12,17-18H2,1-4H3/b30-23-