6,7-dimethoxy-N-[(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-[(1S)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[(2S)-1-(1-naphthalenylamino)-1-oxopropan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[(2S)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(1-naphthylamino)ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)NC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)NC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C25H27N3O4/c1-16(24(29)27-21-10-6-8-17-7-4-5-9-20(17)21)26-25(30)28-12-11-18-13-22(31-2)23(32-3)14-19(18)15-28/h4-10,13-14,16H,11-12,15H2,1-3H3,(H,26,30)(H,27,29)/t16-/m0/s1