[(2-methylpropan-2-yl)oxycarbonylamino] [4-(dimethylamino)-2-(2-oxidanylideneethyl)cyclohexyl]methanesulfonate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] [4-(dimethylamino)-2-(2-oxidanylideneethyl)cyclohexyl]methanesulfonate Openeye Name: (tert-butoxycarbonylamino) [4-(dimethylamino)-2-(2-oxoethyl)cyclohexyl]methanesulfonate CAS Name: [4-(dimethylamino)-2-(2-oxoethyl)cyclohexyl]methanesulfonic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] [4-(dimethylamino)-2-(2-oxoethyl)cyclohexyl]methanesulfonate Traditional Name: [4-(dimethylamino)-2-(2-ketoethyl)cyclohexyl]methanesulfonic acid (tert-butoxycarbonylamino) ester Formula: C16H30N2O6S MolecularWeight: 378.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOS(=O)(=O)CC1CCC(CC1CC=O)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NOS(=O)(=O)CC1CCC(CC1CC=O)N(C)C

InChI

InChI=1S/C16H30N2O6S/c1-16(2,3)23-15(20)17-24-25(21,22)11-13-6-7-14(18(4)5)10-12(13)8-9-19/h9,12-14H,6-8,10-11H2,1-5H3,(H,17,20)