(4-chloranyl-2-methoxy-phenyl) 2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: (4-chloranyl-2-methoxy-phenyl) 2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: (4-chloro-2-methoxy-phenyl) 2-(2-methoxyphenyl)-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-(2-methoxyphenyl)-1-oxo-4-isoquinolinecarboxylic acid (4-chloro-2-methoxyphenyl) ester IUPAC Name: (4-chloro-2-methoxyphenyl) 2-(2-methoxyphenyl)-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-(2-methoxyphenyl)isoquinoline-4-carboxylic acid (4-chloro-2-methoxy-phenyl) ester Formula: C24H18ClNO5 MolecularWeight: 435.85642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)OC4=C(C=C(C=C4)Cl)OC

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)OC4=C(C=C(C=C4)Cl)OC

InChI

InChI=1S/C24H18ClNO5/c1-29-20-10-6-5-9-19(20)26-14-18(16-7-3-4-8-17(16)23(26)27)24(28)31-21-12-11-15(25)13-22(21)30-2/h3-14H,1-2H3