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

Systemtic Name: N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-4-nitro-benzamide Openeye Name: N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-4-nitro-benzamide CAS Name: N-[3-[4-(4-methyl-1-piperazinyl)phenyl]propyl]-4-nitrobenzamide IUPAC Name: N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-4-nitrobenzamide Traditional Name: N-[3-[4-(4-methylpiperazino)phenyl]propyl]-4-nitro-benzamide Formula: C21H26N4O3 MolecularWeight: 382.45614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-23-13-15-24(16-14-23)19-8-4-17(5-9-19)3-2-12-22-21(26)18-6-10-20(11-7-18)25(27)28/h4-11H,2-3,12-16H2,1H3,(H,22,26)