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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-17-16-19(7-10-21(17)26(28)29)22(27)23-11-3-4-18-5-8-20(9-6-18)25-14-12-24(2)13-15-25/h5-10,16H,3-4,11-15H2,1-2H3,(H,23,27)