2-[4-(3-methyl-4-nitro-phenyl)carbonylpiperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(3-methyl-4-nitro-phenyl)carbonylpiperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(3-methyl-4-nitro-benzoyl)piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(3-methyl-4-nitrophenyl)-oxomethyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-(3-methyl-4-nitrobenzoyl)piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-(3-methyl-4-nitro-benzoyl)piperazino]-N-propyl-acetamide Formula: C17H24N4O4 MolecularWeight: 348.39686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O4/c1-3-6-18-16(22)12-19-7-9-20(10-8-19)17(23)14-4-5-15(21(24)25)13(2)11-14/h4-5,11H,3,6-10,12H2,1-2H3,(H,18,22)