1-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-9H-$b-carboline-3-carboxamide Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4N2

InChI

InChI=1S/C20H24N4O2/c1-14-19-16(15-5-2-3-6-17(15)23-19)13-18(22-14)20(25)21-7-4-8-24-9-11-26-12-10-24/h2-3,5-6,13,23H,4,7-12H2,1H3,(H,21,25)/p+1