N-[(1R,2S)-2-cyano-1-(4-methoxyphenyl)-2-oxidanyl-ethyl]benzamide

Systemtic Name: N-[(1R,2S)-2-cyano-1-(4-methoxyphenyl)-2-oxidanyl-ethyl]benzamide Openeye Name: N-[(1R,2S)-2-cyano-2-hydroxy-1-(4-methoxyphenyl)ethyl]benzamide CAS Name: N-[(1R,2S)-2-cyano-2-hydroxy-1-(4-methoxyphenyl)ethyl]benzamide IUPAC Name: N-[(1R,2S)-2-cyano-2-hydroxy-1-(4-methoxyphenyl)ethyl]benzamide Traditional Name: N-[(1R,2S)-2-cyano-2-hydroxy-1-(4-methoxyphenyl)ethyl]benzamide Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C#N)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]([C@@H](C#N)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16N2O3/c1-22-14-9-7-12(8-10-14)16(15(20)11-18)19-17(21)13-5-3-2-4-6-13/h2-10,15-16,20H,1H3,(H,19,21)/t15-,16-/m1/s1