ethyl 4-[[(4-methoxyphenyl)methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[(4-methoxyphenyl)methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[(4-methoxyphenyl)methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-methoxyphenyl)methyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(4-methoxyphenyl)methyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[mesitylsulfonyl(p-anisyl)amino]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C27H37NO5S MolecularWeight: 487.65138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CN(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CN(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C27H37NO5S/c1-6-33-27(29)24-11-7-22(8-12-24)17-28(18-23-9-13-25(32-5)14-10-23)34(30,31)26-20(3)15-19(2)16-21(26)4/h9-10,13-16,22,24H,6-8,11-12,17-18H2,1-5H3