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

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO4S/c1-13-17(18(20-24-13)14-7-3-2-4-8-14)19(22)23-11-5-9-15(21)16-10-6-12-25-16/h2-4,6-8,10,12H,5,9,11H2,1H3