ethyl 1-[3-[(3-chlorophenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-[(3-chlorophenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(3-chloroanilino)-3-oxo-propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(3-chloroanilino)-3-oxopropyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3-chloroanilino)-3-oxopropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(3-chloroanilino)-3-keto-propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H24ClN2O3+ MolecularWeight: 339.83706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H23ClN2O3/c1-2-23-17(22)13-6-9-20(10-7-13)11-8-16(21)19-15-5-3-4-14(18)12-15/h3-5,12-13H,2,6-11H2,1H3,(H,19,21)/p+1