[2-(dimethylamino)cyclohexyl] 1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propane-1-sulfonate

Systemtic Name: [2-(dimethylamino)cyclohexyl] 1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propane-1-sulfonate Openeye Name: [2-(dimethylamino)cyclohexyl] 1-(tert-butoxycarbonylamino)-3-oxo-propane-1-sulfonate CAS Name: 1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-1-propanesulfonic acid IUPAC Name: [2-(dimethylamino)cyclohexyl] 1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropane-1-sulfonate Traditional Name: 1-(tert-butoxycarbonylamino)-3-keto-propane-1-sulfonic acid [2-(dimethylamino)cyclohexyl] ester Formula: C16H30N2O6S MolecularWeight: 378.4842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC=O)S(=O)(=O)OC1CCCCC1N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC=O)S(=O)(=O)OC1CCCCC1N(C)C

InChI

InChI=1S/C16H30N2O6S/c1-16(2,3)23-15(20)17-14(10-11-19)25(21,22)24-13-9-7-6-8-12(13)18(4)5/h11-14H,6-10H2,1-5H3,(H,17,20)