2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-(4-benzoyl-2-nitrophenyl)-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(4-benzoyl-2-nitrophenyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazino]-1-pyrrolidino-ethanone Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c28-22(26-10-4-5-11-26)17-24-12-14-25(15-13-24)20-9-8-19(16-21(20)27(30)31)23(29)18-6-2-1-3-7-18/h1-3,6-9,16H,4-5,10-15,17H2