methyl 1-[[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(2,4-dimethylphenyl)sulfonylisonipecotoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C22H32N2O5S MolecularWeight: 436.56488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC)C

InChI

InChI=1S/C22H32N2O5S/c1-16-7-8-19(17(2)15-16)30(27,28)24-13-9-18(10-14-24)20(25)23-22(21(26)29-3)11-5-4-6-12-22/h7-8,15,18H,4-6,9-14H2,1-3H3,(H,23,25)