N-(3-chloranyl-4-methoxy-phenyl)-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-(3,4-dimethylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(3,4-dimethylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(3,4-dimethylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-(3,4-dimethylphenyl)-1-keto-isoquinoline-4-carboxamide Formula: C25H21ClN2O3 MolecularWeight: 432.89884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC(=C(C=C4)OC)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC(=C(C=C4)OC)Cl)C

InChI

InChI=1S/C25H21ClN2O3/c1-15-8-10-18(12-16(15)2)28-14-21(19-6-4-5-7-20(19)25(28)30)24(29)27-17-9-11-23(31-3)22(26)13-17/h4-14H,1-3H3,(H,27,29)