3-[4-(4-chlorophenyl)-2-sulfanylidene-3H-1,3-oxazol-5-yl]propanoic acid

Systemtic Name: 3-[4-(4-chlorophenyl)-2-sulfanylidene-3H-1,3-oxazol-5-yl]propanoic acid Openeye Name: 3-[4-(4-chlorophenyl)-2-thioxo-3H-oxazol-5-yl]propanoic acid CAS Name: 3-[4-(4-chlorophenyl)-2-sulfanylidene-3H-oxazol-5-yl]propanoic acid IUPAC Name: 3-[4-(4-chlorophenyl)-2-sulfanylidene-3H-1,3-oxazol-5-yl]propanoic acid Traditional Name: 3-[4-(4-chlorophenyl)-2-thioxo-4-oxazolin-5-yl]propionic acid Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(OC(=S)N2)CCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(OC(=S)N2)CCC(=O)O)Cl

InChI

InChI=1S/C12H10ClNO3S/c13-8-3-1-7(2-4-8)11-9(5-6-10(15)16)17-12(18)14-11/h1-4H,5-6H2,(H,14,18)(H,15,16)