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

Systemtic Name: N-cyclopentyl-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-cyclopentyl-2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-cyclopentyl-2-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-cyclopentyl-2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-cyclopentyl-1-keto-2-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4CCCC4

InChI

InChI=1S/C22H22N2O3/c1-27-17-10-6-9-16(13-17)24-14-20(21(25)23-15-7-2-3-8-15)18-11-4-5-12-19(18)22(24)26/h4-6,9-15H,2-3,7-8H2,1H3,(H,23,25)