ethyl 4-[[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[(4-chlorophenyl)methyl-(p-tolylsulfonyl)amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[(4-chlorobenzyl)-tosyl-amino]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C24H30ClNO4S MolecularWeight: 464.0173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H30ClNO4S/c1-3-30-24(27)21-10-6-19(7-11-21)16-26(17-20-8-12-22(25)13-9-20)31(28,29)23-14-4-18(2)5-15-23/h4-5,8-9,12-15,19,21H,3,6-7,10-11,16-17H2,1-2H3