15798-64-8 Purity
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Specification
The molecular formula is C16H13NO3.
The molecular weight is 267.28 g/mol.
The IUPAC name is (4S,5R)-2,4-diphenyl-4,5-dihydro-1,3-oxazole-5-carboxylic acid.
The InChI is InChI=1S/C16H13NO3/c18-16(19)14-13(11-7-3-1-4-8-11)17-15(20-14)12-9-5-2-6-10-12/h1-10,13-14H,(H,18,19)/t13-,14+/m0/s1.
The InChIKey is BPBOFBFRBITMMR-UONOGXRCSA-N.
The canonical SMILES is C1=CC=C(C=C1)C2C(OC(=N2)C3=CC=CC=C3)C(=O)O.
The isomeric SMILES is C1=CC=C(C=C1)[C@H]2[C@@H](OC(=N2)C3=CC=CC=C3)C(=O)O.
The CAS number is 158722-22-6.
The molecular weight is 267.28 g/mol.
Yes, it is a defined compound in PubChem.
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