2-[[(1R,2R)-2-oxidanylcyclohexyl]amino]benzoate

Systemtic Name: 2-[[(1R,2R)-2-oxidanylcyclohexyl]amino]benzoate Openeye Name: 2-[[(1R,2R)-2-hydroxycyclohexyl]amino]benzoate CAS Name: 2-[[(1R,2R)-2-hydroxycyclohexyl]amino]benzoate IUPAC Name: 2-[[(1R,2R)-2-hydroxycyclohexyl]amino]benzoate Traditional Name: 2-[[(1R,2R)-2-hydroxycyclohexyl]amino]benzoate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC2=CC=CC=C2C(=O)[O-])O

Isomeric SMILES

C1CC[C@H]([C@@H](C1)NC2=CC=CC=C2C(=O)[O-])O

InChI

InChI=1S/C13H17NO3/c15-12-8-4-3-7-11(12)14-10-6-2-1-5-9(10)13(16)17/h1-2,5-6,11-12,14-15H,3-4,7-8H2,(H,16,17)/p-1/t11-,12-/m1/s1