2-(azepan-1-ium-1-yl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-(3-cyano-1-methyl-4,5,6,7-tetrahydroindol-2-yl)acetamide Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CCCC2)C(=C1NC(=O)C[NH+]3CCCCCC3)C#N

Isomeric SMILES

CN1C2=C(CCCC2)C(=C1NC(=O)C[NH+]3CCCCCC3)C#N

InChI

InChI=1S/C18H26N4O/c1-21-16-9-5-4-8-14(16)15(12-19)18(21)20-17(23)13-22-10-6-2-3-7-11-22/h2-11,13H2,1H3,(H,20,23)/p+1