(phenylmethyl) N-[(1R,2S,3S)-3-cyano-2-oxidanyl-cyclohexyl]carbamate

Systemtic Name: (phenylmethyl) N-[(1R,2S,3S)-3-cyano-2-oxidanyl-cyclohexyl]carbamate Openeye Name: benzyl N-[(1R,2S,3S)-3-cyano-2-hydroxy-cyclohexyl]carbamate CAS Name: N-[(1R,2S,3S)-3-cyano-2-hydroxycyclohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(1R,2S,3S)-3-cyano-2-hydroxycyclohexyl]carbamate Traditional Name: N-[(1R,2S,3S)-3-cyano-2-hydroxy-cyclohexyl]carbamic acid benzyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1)NC(=O)OCC2=CC=CC=C2)O)C#N

Isomeric SMILES

C1C[C@H]([C@@H]([C@@H](C1)NC(=O)OCC2=CC=CC=C2)O)C#N

InChI

InChI=1S/C15H18N2O3/c16-9-12-7-4-8-13(14(12)18)17-15(19)20-10-11-5-2-1-3-6-11/h1-3,5-6,12-14,18H,4,7-8,10H2,(H,17,19)/t12-,13+,14-/m0/s1