(phenylmethyl) (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylate

Systemtic Name: (phenylmethyl) (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylate Openeye Name: benzyl (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylate CAS Name: (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylate Traditional Name: (2S,3R)-6-(cyanomethyl)-2,3-diphenyl-2,3-dihydro-1,4-oxazine-4-carboxylic acid benzyl ester Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C=C(OC(C2C3=CC=CC=C3)C4=CC=CC=C4)CC#N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C=C(O[C@H]([C@H]2C3=CC=CC=C3)C4=CC=CC=C4)CC#N

InChI

InChI=1S/C26H22N2O3/c27-17-16-23-18-28(26(29)30-19-20-10-4-1-5-11-20)24(21-12-6-2-7-13-21)25(31-23)22-14-8-3-9-15-22/h1-15,18,24-25H,16,19H2/t24-,25+/m1/s1