2-[4-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(5-nitro-2-pyrrolidin-1-yl-benzoyl)piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-(5-nitro-2-pyrrolidin-1-ylbenzoyl)piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(5-nitro-2-pyrrolidino-benzoyl)piperazino]-N-phenyl-acetamide Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O4/c29-22(24-18-6-2-1-3-7-18)17-25-12-14-27(15-13-25)23(30)20-16-19(28(31)32)8-9-21(20)26-10-4-5-11-26/h1-3,6-9,16H,4-5,10-15,17H2,(H,24,29)