N-butyl-2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazin-1-yl]-N-butyl-acetamide CAS Name: 2-[4-(4-benzoyl-2-nitrophenyl)-1-piperazinyl]-N-butylacetamide IUPAC Name: 2-[4-(4-benzoyl-2-nitrophenyl)piperazin-1-yl]-N-butylacetamide Traditional Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazino]-N-butyl-acetamide Formula: C23H28N4O4 MolecularWeight: 424.49282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c1-2-3-11-24-22(28)17-25-12-14-26(15-13-25)20-10-9-19(16-21(20)27(30)31)23(29)18-7-5-4-6-8-18/h4-10,16H,2-3,11-15,17H2,1H3,(H,24,28)