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

Systemtic Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H22N4O3/c1-14-17(4-3-5-18(14)23(25)26)19(24)20-15-6-8-16(9-7-15)22-12-10-21(2)11-13-22/h3-9H,10-13H2,1-2H3,(H,20,24)/p+1