methyl 3-[4-tert-butyl-1-[(4-methylphenyl)sulfonylamino]cyclohexyl]propanoate

Systemtic Name: methyl 3-[4-tert-butyl-1-[(4-methylphenyl)sulfonylamino]cyclohexyl]propanoate Openeye Name: methyl 3-[4-tert-butyl-1-(p-tolylsulfonylamino)cyclohexyl]propanoate CAS Name: 3-[4-tert-butyl-1-[(4-methylphenyl)sulfonylamino]cyclohexyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-tert-butyl-1-[(4-methylphenyl)sulfonylamino]cyclohexyl]propanoate Traditional Name: 3-[4-tert-butyl-1-(tosylamino)cyclohexyl]propionic acid methyl ester Formula: C21H33NO4S MolecularWeight: 395.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2(CCC(CC2)C(C)(C)C)CCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2(CCC(CC2)C(C)(C)C)CCC(=O)OC

InChI

InChI=1S/C21H33NO4S/c1-16-6-8-18(9-7-16)27(24,25)22-21(15-12-19(23)26-5)13-10-17(11-14-21)20(2,3)4/h6-9,17,22H,10-15H2,1-5H3