[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] (2R)-2-hydroxy-2-phenyl-acetate CAS Name: (2R)-2-hydroxy-2-phenylacetic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] (2R)-2-hydroxy-2-phenylacetate Traditional Name: (2R)-2-hydroxy-2-phenyl-acetic acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)O

InChI

InChI=1S/C18H16N2O4/c19-11-10-13-6-8-15(9-7-13)20-16(21)12-24-18(23)17(22)14-4-2-1-3-5-14/h1-9,17,22H,10,12H2,(H,20,21)/t17-/m1/s1