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

Systemtic Name: 6,7-dimethoxy-N-[3-(3-methylbutylamino)-3-oxidanylidene-propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[3-(isopentylamino)-3-oxo-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[3-(3-methylbutylamino)-3-oxopropyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[3-(3-methylbutylamino)-3-oxopropyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[3-(isoamylamino)-3-keto-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CCNC(=O)N1CCC2=CC(=C(C=C2C1)OC)OC

Isomeric SMILES

CC(C)CCNC(=O)CCNC(=O)N1CCC2=CC(=C(C=C2C1)OC)OC

InChI

InChI=1S/C20H31N3O4/c1-14(2)5-8-21-19(24)6-9-22-20(25)23-10-7-15-11-17(26-3)18(27-4)12-16(15)13-23/h11-12,14H,5-10,13H2,1-4H3,(H,21,24)(H,22,25)