ethyl 4-(4-ethoxy-3,5-dimethoxy-phenyl)-1-oxidanylidene-2-phenyl-isoquinoline-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxy-3,5-dimethoxy-phenyl)-1-oxidanylidene-2-phenyl-isoquinoline-3-carboxylate Openeye Name: ethyl 4-(4-ethoxy-3,5-dimethoxy-phenyl)-1-oxo-2-phenyl-isoquinoline-3-carboxylate CAS Name: 4-(4-ethoxy-3,5-dimethoxyphenyl)-1-oxo-2-phenyl-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxy-3,5-dimethoxyphenyl)-1-oxo-2-phenylisoquinoline-3-carboxylate Traditional Name: 4-(4-ethoxy-3,5-dimethoxy-phenyl)-1-keto-2-phenyl-isoquinoline-3-carboxylic acid ethyl ester Formula: C28H27NO6 MolecularWeight: 473.51708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1OC)C2=C(N(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1OC)C2=C(N(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C(=O)OCC)OC

InChI

InChI=1S/C28H27NO6/c1-5-34-26-22(32-3)16-18(17-23(26)33-4)24-20-14-10-11-15-21(20)27(30)29(19-12-8-7-9-13-19)25(24)28(31)35-6-2/h7-17H,5-6H2,1-4H3