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

Systemtic Name: 2-[4-[4-(methylamino)-3-nitro-phenyl]carbonylpiperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[4-(methylamino)-3-nitro-benzoyl]piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-[4-(methylamino)-3-nitrobenzoyl]piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[4-(methylamino)-3-nitro-benzoyl]piperazino]-N-phenyl-acetamide Formula: C20H23N5O4 MolecularWeight: 397.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c1-21-17-8-7-15(13-18(17)25(28)29)20(27)24-11-9-23(10-12-24)14-19(26)22-16-5-3-2-4-6-16/h2-8,13,21H,9-12,14H2,1H3,(H,22,26)