N-[3-(methylcarbamoyl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[3-(methylcarbamoyl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-(methylcarbamoyl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[3-(methylcarbamoyl)phenyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[3-(methylcarbamoyl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(methylcarbamoyl)phenyl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C20H23N5O4 MolecularWeight: 397.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c1-21-19(26)14-4-3-5-16(12-14)22-20(27)15-6-7-17(18(13-15)25(28)29)24-10-8-23(2)9-11-24/h3-7,12-13H,8-11H2,1-2H3,(H,21,26)(H,22,27)