ethyl 2-methylsulfanyl-5-(4-nitrophenyl)-1,3-oxazole-4-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-5-(4-nitrophenyl)-1,3-oxazole-4-carboxylate Openeye Name: ethyl 2-methylsulfanyl-5-(4-nitrophenyl)oxazole-4-carboxylate CAS Name: 2-(methylthio)-5-(4-nitrophenyl)-4-oxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-5-(4-nitrophenyl)-1,3-oxazole-4-carboxylate Traditional Name: 2-(methylthio)-5-(4-nitrophenyl)oxazole-4-carboxylic acid ethyl ester Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=N1)SC)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(OC(=N1)SC)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5S/c1-3-19-12(16)10-11(20-13(14-10)21-2)8-4-6-9(7-5-8)15(17)18/h4-7H,3H2,1-2H3