5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylic acid Openeye Name: 2-(benzyloxycarbonylamino)-5-(tert-butoxycarbonylamino)cyclohexanecarboxylic acid CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)-1-cyclohexanecarboxylic acid IUPAC Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylic acid Traditional Name: 2-(benzyloxycarbonylamino)-5-(tert-butoxycarbonylamino)cyclohexanecarboxylic acid Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(C(C1)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(C(C1)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O6/c1-20(2,3)28-19(26)21-14-9-10-16(15(11-14)17(23)24)22-18(25)27-12-13-7-5-4-6-8-13/h4-8,14-16H,9-12H2,1-3H3,(H,21,26)(H,22,25)(H,23,24)