ethyl 1-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(benzylcarbamoylamino)-3-oxo-propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-oxo-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(benzylcarbamoylamino)-3-oxopropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(benzylcarbamoylamino)-3-keto-propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H28N3O4+ MolecularWeight: 362.44332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O4/c1-2-26-18(24)16-8-11-22(12-9-16)13-10-17(23)21-19(25)20-14-15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H2,20,21,23,25)/p+1