N-[3-(azepan-1-yl)propyl]-2-cyclopentyl-9-methyl-1-oxidanylidene-pyrido[3,4-b]indole-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-cyclopentyl-9-methyl-1-oxidanylidene-pyrido[3,4-b]indole-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-cyclopentyl-9-methyl-1-oxo-pyrido[3,4-b]indole-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-2-cyclopentyl-9-methyl-1-oxo-4-pyrido[3,4-b]indolecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-cyclopentyl-9-methyl-1-oxopyrido[3,4-b]indole-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-cyclopentyl-1-keto-9-methyl-$b-carboline-4-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C1C(=O)N(C=C3C(=O)NCCCN4CCCCCC4)C5CCCC5

Isomeric SMILES

CN1C2=CC=CC=C2C3=C1C(=O)N(C=C3C(=O)NCCCN4CCCCCC4)C5CCCC5

InChI

InChI=1S/C27H36N4O2/c1-29-23-14-7-6-13-21(23)24-22(19-31(27(33)25(24)29)20-11-4-5-12-20)26(32)28-15-10-18-30-16-8-2-3-9-17-30/h6-7,13-14,19-20H,2-5,8-12,15-18H2,1H3,(H,28,32)