(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

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