3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propyl]cyclohexane-1-carboxylic acid

Systemtic Name: 3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propyl]cyclohexane-1-carboxylic acid Openeye Name: 3-[2-(tert-butoxycarbonylamino)-3-sulfanyl-propyl]cyclohexanecarboxylic acid CAS Name: 3-[3-mercapto-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-1-cyclohexanecarboxylic acid IUPAC Name: 3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropyl]cyclohexane-1-carboxylic acid Traditional Name: 3-[2-(tert-butoxycarbonylamino)-3-mercapto-propyl]cyclohexanecarboxylic acid Formula: C15H27NO4S MolecularWeight: 317.44418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCC(C1)C(=O)O)CS

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCC(C1)C(=O)O)CS

InChI

InChI=1S/C15H27NO4S/c1-15(2,3)20-14(19)16-12(9-21)8-10-5-4-6-11(7-10)13(17)18/h10-12,21H,4-9H2,1-3H3,(H,16,19)(H,17,18)