4-[4-(1,3-oxazol-5-yl)phenyl]phenol; 2-sulfanylpropanoic acid

Systemtic Name: 4-[4-(1,3-oxazol-5-yl)phenyl]phenol; 2-sulfanylpropanoic acid Openeye Name: 4-(4-oxazol-5-ylphenyl)phenol; 2-sulfanylpropanoic acid CAS Name: 2-mercaptopropanoic acid; 4-[4-(5-oxazolyl)phenyl]phenol IUPAC Name: 4-[4-(1,3-oxazol-5-yl)phenyl]phenol; 2-sulfanylpropanoic acid Traditional Name: 2-mercaptopropionic acid; 4-(4-oxazol-5-ylphenyl)phenol Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S.C1=CC(=CC=C1C2=CC=C(C=C2)O)C3=CN=CO3

Isomeric SMILES

CC(C(=O)O)S.C1=CC(=CC=C1C2=CC=C(C=C2)O)C3=CN=CO3

InChI

InChI=1S/C15H11NO2.C3H6O2S/c17-14-7-5-12(6-8-14)11-1-3-13(4-2-11)15-9-16-10-18-15;1-2(6)3(4)5/h1-10,17H;2,6H,1H3,(H,4,5)