(1R,2S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-1-(tert-butoxycarbonylamino)-2-phenyl-cyclohexanecarboxylic acid CAS Name: (1R,2S)-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylcyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-1-(tert-butoxycarbonylamino)-2-phenyl-cyclohexanecarboxylic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCCCC1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@]1(CCCC[C@H]1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H25NO4/c1-17(2,3)23-16(22)19-18(15(20)21)12-8-7-11-14(18)13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3,(H,19,22)(H,20,21)/t14-,18+/m0/s1