[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] (2R)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] (2R)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] (2R)-2-hydroxy-2-phenyl-acetate CAS Name: (2R)-2-hydroxy-2-phenylacetic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] (2R)-2-hydroxy-2-phenylacetate Traditional Name: (2R)-2-hydroxy-2-phenyl-acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)[C@@H](C2=CC=CC=C2)O

InChI

InChI=1S/C17H20N2O4/c18-12-17(9-5-2-6-10-17)19-14(20)11-23-16(22)15(21)13-7-3-1-4-8-13/h1,3-4,7-8,15,21H,2,5-6,9-11H2,(H,19,20)/t15-/m1/s1