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

Systemtic Name: 2-[4-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(5-nitro-2-pyrrolidin-1-yl-benzoyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(5-nitro-2-pyrrolidin-1-ylbenzoyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(5-nitro-2-pyrrolidino-benzoyl)piperazino]acetamide Formula: C24H29N5O4 MolecularWeight: 451.51816

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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)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H29N5O4/c30-23(25-17-19-6-2-1-3-7-19)18-26-12-14-28(15-13-26)24(31)21-16-20(29(32)33)8-9-22(21)27-10-4-5-11-27/h1-3,6-9,16H,4-5,10-15,17-18H2,(H,25,30)