N-[3-(azepan-1-yl)propyl]-2-methyl-3-(1-methylindol-3-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-methyl-3-(1-methylindol-3-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-methyl-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-2-methyl-3-(1-methyl-3-indolyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-methyl-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-keto-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C29H36N4O2 MolecularWeight: 472.62174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3C(C4=CC=CC=C4C(=O)N3C)C(=O)NCCCN5CCCCCC5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3C(C4=CC=CC=C4C(=O)N3C)C(=O)NCCCN5CCCCCC5

InChI

InChI=1S/C29H36N4O2/c1-31-20-24(21-12-7-8-15-25(21)31)27-26(22-13-5-6-14-23(22)29(35)32(27)2)28(34)30-16-11-19-33-17-9-3-4-10-18-33/h5-8,12-15,20,26-27H,3-4,9-11,16-19H2,1-2H3,(H,30,34)