methyl 6-methoxy-1-oxidanylidene-4-phenyl-2-(phenylmethyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 6-methoxy-1-oxidanylidene-4-phenyl-2-(phenylmethyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-benzyl-6-methoxy-1-oxo-4-phenyl-isoquinoline-3-carboxylate CAS Name: 6-methoxy-1-oxo-4-phenyl-2-(phenylmethyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-6-methoxy-1-oxo-4-phenylisoquinoline-3-carboxylate Traditional Name: 2-benzyl-1-keto-6-methoxy-4-phenyl-isoquinoline-3-carboxylic acid methyl ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C25H21NO4/c1-29-19-13-14-20-21(15-19)22(18-11-7-4-8-12-18)23(25(28)30-2)26(24(20)27)16-17-9-5-3-6-10-17/h3-15H,16H2,1-2H3