[4-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]methyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: [4-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]methyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: [4-(p-tolylsulfonylmethyl)cyclohexyl]methyl 3-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 3-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid [4-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]methyl ester IUPAC Name: [4-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]methyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 3-(tosylcarbamoylamino)benzoic acid [4-(tosylmethyl)cyclohexyl]methyl ester Formula: C30H34N2O7S2 MolecularWeight: 598.73016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CCC(CC2)COC(=O)C3=CC(=CC=C3)NC(=O)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2CCC(CC2)COC(=O)C3=CC(=CC=C3)NC(=O)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H34N2O7S2/c1-21-6-14-27(15-7-21)40(35,36)20-24-12-10-23(11-13-24)19-39-29(33)25-4-3-5-26(18-25)31-30(34)32-41(37,38)28-16-8-22(2)9-17-28/h3-9,14-18,23-24H,10-13,19-20H2,1-2H3,(H2,31,32,34)