4-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]-3-nitro-benzamide

Systemtic Name: 4-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]-3-nitro-benzamide Openeye Name: 3-nitro-4-[[1-(p-tolylsulfonyl)-4-piperidyl]amino]benzamide CAS Name: 4-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]amino]-3-nitrobenzamide IUPAC Name: 4-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]-3-nitrobenzamide Traditional Name: 3-nitro-4-[(1-tosyl-4-piperidyl)amino]benzamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-13-2-5-16(6-3-13)29(27,28)22-10-8-15(9-11-22)21-17-7-4-14(19(20)24)12-18(17)23(25)26/h2-7,12,15,21H,8-11H2,1H3,(H2,20,24)