N-methyl-1-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-1-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(benzylcarbamoylamino)-3-oxo-propyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[3-oxo-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(benzylcarbamoylamino)-3-oxopropyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(benzylcarbamoylamino)-3-keto-propyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O3/c1-19-17(24)15-7-10-22(11-8-15)12-9-16(23)21-18(25)20-13-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3,(H,19,24)(H2,20,21,23,25)/p+1