N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-1-keto-2-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H21ClN2O4/c1-15-11-22(23(32-3)13-21(15)26)27-24(29)20-14-28(16-7-6-8-17(12-16)31-2)25(30)19-10-5-4-9-18(19)20/h4-14H,1-3H3,(H,27,29)