1-[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(4-cyanoanilino)-3-oxo-propyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(4-cyanoanilino)-3-oxopropyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(4-cyanoanilino)-3-oxopropyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(4-cyanoanilino)-3-keto-propyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H22N4O2/c1-19-17(23)14-6-9-21(10-7-14)11-8-16(22)20-15-4-2-13(12-18)3-5-15/h2-5,14H,6-11H2,1H3,(H,19,23)(H,20,22)/p+1