N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide CAS Name: N-[2-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-3-nitrobenzamide Traditional Name: N-[2-[4-(m-tolyl)piperazino]sulfonylethyl]-3-nitro-benzamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S/c1-16-4-2-6-18(14-16)22-9-11-23(12-10-22)30(28,29)13-8-21-20(25)17-5-3-7-19(15-17)24(26)27/h2-7,14-15H,8-13H2,1H3,(H,21,25)