5-[3-(4-methoxyphenyl)phenyl]-1,3-oxazole; 2-sulfanylpropanoic acid

Systemtic Name: 5-[3-(4-methoxyphenyl)phenyl]-1,3-oxazole; 2-sulfanylpropanoic acid Openeye Name: 5-[3-(4-methoxyphenyl)phenyl]oxazole; 2-sulfanylpropanoic acid CAS Name: 2-mercaptopropanoic acid; 5-[3-(4-methoxyphenyl)phenyl]oxazole IUPAC Name: 5-[3-(4-methoxyphenyl)phenyl]-1,3-oxazole; 2-sulfanylpropanoic acid Traditional Name: 2-mercaptopropionic acid; 5-[3-(4-methoxyphenyl)phenyl]oxazole Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S.COC1=CC=C(C=C1)C2=CC(=CC=C2)C3=CN=CO3

Isomeric SMILES

CC(C(=O)O)S.COC1=CC=C(C=C1)C2=CC(=CC=C2)C3=CN=CO3

InChI

InChI=1S/C16H13NO2.C3H6O2S/c1-18-15-7-5-12(6-8-15)13-3-2-4-14(9-13)16-10-17-11-19-16;1-2(6)3(4)5/h2-11H,1H3;2,6H,1H3,(H,4,5)