(2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C17H13NO4S MolecularWeight: 327.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C17H13NO4S/c1-11-15(16(18-22-11)12-6-3-2-4-7-12)17(20)21-10-13(19)14-8-5-9-23-14/h2-9H,10H2,1H3