methyl 3-(tert-butylamino)-2-cyclohexyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-(tert-butylamino)-2-cyclohexyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-(tert-butylamino)-2-cyclohexyl-3-oxo-2-(p-tolylsulfonyloxymethyl)propanoate CAS Name: 3-(tert-butylamino)-2-cyclohexyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(tert-butylamino)-2-cyclohexyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxopropanoate Traditional Name: 3-(tert-butylamino)-2-cyclohexyl-3-keto-2-(tosyloxymethyl)propionic acid methyl ester Formula: C22H33NO6S MolecularWeight: 439.56552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2CCCCC2)(C(=O)NC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2CCCCC2)(C(=O)NC(C)(C)C)C(=O)OC

InChI

InChI=1S/C22H33NO6S/c1-16-11-13-18(14-12-16)30(26,27)29-15-22(20(25)28-5,17-9-7-6-8-10-17)19(24)23-21(2,3)4/h11-14,17H,6-10,15H2,1-5H3,(H,23,24)