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

Systemtic Name: 6,7-dimethoxy-N-[3-(naphthalen-1-ylamino)-3-oxidanylidene-propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-[3-(1-naphthylamino)-3-oxo-propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[3-(1-naphthalenylamino)-3-oxopropyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[3-(naphthalen-1-ylamino)-3-oxopropyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[3-keto-3-(1-naphthylamino)propyl]-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:

COC1=C(C=C2CN(CCC2=C1)C(=O)NCCC(=O)NC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NCCC(=O)NC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C25H27N3O4/c1-31-22-14-18-11-13-28(16-19(18)15-23(22)32-2)25(30)26-12-10-24(29)27-21-9-5-7-17-6-3-4-8-20(17)21/h3-9,14-15H,10-13,16H2,1-2H3,(H,26,30)(H,27,29)