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

Systemtic Name: 2-methyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[3-[4-(4-methyl-1-piperazinyl)phenyl]propyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[3-[4-(4-methylpiperazino)phenyl]propyl]-3-nitro-benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCCC2=CC=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCCC2=CC=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H28N4O3/c1-17-20(6-3-7-21(17)26(28)29)22(27)23-12-4-5-18-8-10-19(11-9-18)25-15-13-24(2)14-16-25/h3,6-11H,4-5,12-16H2,1-2H3,(H,23,27)