N-(2,3-dimethylcyclohexyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H28N2O3/c1-16-7-6-10-23(17(16)2)26-24(28)22-15-27(18-11-13-19(30-3)14-12-18)25(29)21-9-5-4-8-20(21)22/h4-5,8-9,11-17,23H,6-7,10H2,1-3H3,(H,26,28)