1-(4-chlorophenyl)-N-[[5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]methyl]piperazin-1-ium-1-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[[5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]methyl]piperazin-1-ium-1-carboxamide Openeye Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-1-(4-chlorophenyl)piperazin-1-ium-1-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[[5-oxo-1-(phenylmethyl)-3-pyrrolidinyl]methyl]-1-piperazin-1-iumcarboxamide IUPAC Name: N-[(1-benzyl-5-oxopyrrolidin-3-yl)methyl]-1-(4-chlorophenyl)piperazin-1-ium-1-carboxamide Traditional Name: N-[(1-benzyl-5-keto-pyrrolidin-3-yl)methyl]-1-(4-chlorophenyl)piperazin-1-ium-1-carboxamide Formula: C23H28ClN4O2+ MolecularWeight: 427.94702

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C2=CC=C(C=C2)Cl)C(=O)NCC3CC(=O)N(C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[N+](CCN1)(C2=CC=C(C=C2)Cl)C(=O)NCC3CC(=O)N(C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27ClN4O2/c24-20-6-8-21(9-7-20)28(12-10-25-11-13-28)23(30)26-15-19-14-22(29)27(17-19)16-18-4-2-1-3-5-18/h1-9,19,25H,10-17H2/p+1