N-[(R)-cyclopropyl-(4-methylphenyl)methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-[(R)-cyclopropyl-(4-methylphenyl)methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-[(R)-cyclopropyl(p-tolyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-[(R)-cyclopropyl-(4-methylphenyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-[(R)-cyclopropyl-(4-methylphenyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-[(R)-cyclopropyl(p-tolyl)methyl]-1-keto-2H-isoquinoline-3-carboxamide Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2CC2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C21H20N2O2/c1-13-6-8-14(9-7-13)19(15-10-11-15)23-21(25)18-12-16-4-2-3-5-17(16)20(24)22-18/h2-9,12,15,19H,10-11H2,1H3,(H,22,24)(H,23,25)/t19-/m0/s1