methyl 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxidanylidene-cyclohexyl]sulfanylbenzoate

Systemtic Name: methyl 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxidanylidene-cyclohexyl]sulfanylbenzoate Openeye Name: methyl 4-(1-tert-butoxycarbonyl-2-oxo-cyclohexyl)sulfanylbenzoate CAS Name: 4-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-oxocyclohexyl]thio]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxocyclohexyl]sulfanylbenzoate Traditional Name: 4-[(1-tert-butoxycarbonyl-2-keto-cyclohexyl)thio]benzoic acid methyl ester Formula: C19H24O5S MolecularWeight: 364.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCCCC1=O)SC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCCCC1=O)SC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H24O5S/c1-18(2,3)24-17(22)19(12-6-5-7-15(19)20)25-14-10-8-13(9-11-14)16(21)23-4/h8-11H,5-7,12H2,1-4H3