1-(2-methyl-3-nitro-phenyl)sulfonyl-4-(phenylmethyl)piperidine

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)sulfonyl-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine CAS Name: 1-(2-methyl-3-nitrophenyl)sulfonyl-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-(2-methyl-3-nitrophenyl)sulfonylpiperidine Traditional Name: 4-benzyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O4S/c1-15-18(21(22)23)8-5-9-19(15)26(24,25)20-12-10-17(11-13-20)14-16-6-3-2-4-7-16/h2-9,17H,10-14H2,1H3