N-(4-chlorophenyl)-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-chlorophenyl)-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(4-chlorophenyl)-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-chlorophenyl)-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-chlorophenyl)-4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(4-chlorophenyl)-4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-carboxamide Formula: C17H24ClN4O2+ MolecularWeight: 351.85106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H23ClN4O2/c18-14-3-5-15(6-4-14)19-17(24)22-11-9-20(10-12-22)13-16(23)21-7-1-2-8-21/h3-6H,1-2,7-13H2,(H,19,24)/p+1