methyl 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylate CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3-benzoxazole-5-carboxylate Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C17H12ClNO4S MolecularWeight: 361.79948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClNO4S/c1-22-16(21)11-4-7-15-13(8-11)19-17(23-15)24-9-14(20)10-2-5-12(18)6-3-10/h2-8H,9H2,1H3