1-[4-(4-chlorophenyl)-4-(phenylmethyl)piperazin-4-ium-2-yl]-2-pyrrolidin-1-yl-ethane-1,2-dione

Systemtic Name: 1-[4-(4-chlorophenyl)-4-(phenylmethyl)piperazin-4-ium-2-yl]-2-pyrrolidin-1-yl-ethane-1,2-dione Openeye Name: 1-[4-benzyl-4-(4-chlorophenyl)piperazin-4-ium-2-yl]-2-pyrrolidin-1-yl-ethane-1,2-dione CAS Name: 1-[4-(4-chlorophenyl)-4-(phenylmethyl)-2-piperazin-4-iumyl]-2-(1-pyrrolidinyl)ethane-1,2-dione IUPAC Name: 1-[4-benzyl-4-(4-chlorophenyl)piperazin-4-ium-2-yl]-2-pyrrolidin-1-ylethane-1,2-dione Traditional Name: 1-[4-benzyl-4-(4-chlorophenyl)piperazin-4-ium-2-yl]-2-pyrrolidino-ethane-1,2-dione Formula: C23H27ClN3O2+ MolecularWeight: 412.93238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=O)C2C[N+](CCN2)(CC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C(=O)C2C[N+](CCN2)(CC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H27ClN3O2/c24-19-8-10-20(11-9-19)27(16-18-6-2-1-3-7-18)15-12-25-21(17-27)22(28)23(29)26-13-4-5-14-26/h1-3,6-11,21,25H,4-5,12-17H2/q+1