(4R,5R)-2-phenyl-4-(sulfanylmethyl)-4,5-dihydro-1,3-oxazole-5-carboxylic acid

Systemtic Name: (4R,5R)-2-phenyl-4-(sulfanylmethyl)-4,5-dihydro-1,3-oxazole-5-carboxylic acid Openeye Name: (4R,5R)-2-phenyl-4-(sulfanylmethyl)-4,5-dihydrooxazole-5-carboxylic acid CAS Name: (4R,5R)-4-(mercaptomethyl)-2-phenyl-4,5-dihydrooxazole-5-carboxylic acid IUPAC Name: (4R,5R)-2-phenyl-4-(sulfanylmethyl)-4,5-dihydro-1,3-oxazole-5-carboxylic acid Traditional Name: (4R,5R)-4-(mercaptomethyl)-2-phenyl-2-oxazoline-5-carboxylic acid Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(O2)C(=O)O)CS

Isomeric SMILES

C1=CC=C(C=C1)C2=N[C@H]([C@@H](O2)C(=O)O)CS

InChI

InChI=1S/C11H11NO3S/c13-11(14)9-8(6-16)12-10(15-9)7-4-2-1-3-5-7/h1-5,8-9,16H,6H2,(H,13,14)/t8-,9+/m0/s1