N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C25H26N2O3/c1-30-20-13-11-19(12-14-20)27-17-23(21-9-5-6-10-22(21)25(27)29)24(28)26-16-15-18-7-3-2-4-8-18/h5-7,9-14,17H,2-4,8,15-16H2,1H3,(H,26,28)