N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-nitro-benzamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-3-methyl-2-nitro-benzamide Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C

InChI

InChI=1S/C19H21ClN4O3/c1-13-4-3-5-15(18(13)24(26)27)19(25)21-16-12-14(20)6-7-17(16)23-10-8-22(2)9-11-23/h3-7,12H,8-11H2,1-2H3,(H,21,25)