2-[5-[4-(4-nitrophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid

Systemtic Name: 2-[5-[4-(4-nitrophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid Openeye Name: 2-[5-[4-(4-nitrophenyl)phenyl]oxazol-2-yl]-2-sulfanyl-acetic acid CAS Name: 2-mercapto-2-[5-[4-(4-nitrophenyl)phenyl]-2-oxazolyl]acetic acid IUPAC Name: 2-[5-[4-(4-nitrophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-[5-[4-(4-nitrophenyl)phenyl]oxazol-2-yl]acetic acid Formula: C17H12N2O5S MolecularWeight: 356.35258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CN=C(O3)C(C(=O)O)S

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CN=C(O3)C(C(=O)O)S

InChI

InChI=1S/C17H12N2O5S/c20-17(21)15(25)16-18-9-14(24-16)12-3-1-10(2-4-12)11-5-7-13(8-6-11)19(22)23/h1-9,15,25H,(H,20,21)