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

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-1-(2-methoxyanilino)isoquinoline-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-1-(2-methoxyanilino)-4-isoquinolinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-1-(2-methoxyanilino)isoquinoline-4-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-1-(o-anisidino)isoquinoline-4-carboxamide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CCCCC4

Isomeric SMILES

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C25H27N3O2/c1-30-23-14-8-7-13-22(23)28-24-20-12-6-5-11-19(20)21(17-27-24)25(29)26-16-15-18-9-3-2-4-10-18/h5-9,11-14,17H,2-4,10,15-16H2,1H3,(H,26,29)(H,27,28)