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

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(4-chlorophenyl)-4-oxidanylidene-butanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-(4-chlorophenyl)-4-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-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-chlorophenyl)-4-oxobutanoate Traditional Name: 4-(4-chlorophenyl)-4-keto-butyric acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C18H14ClNO4S MolecularWeight: 375.82606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClNO4S/c19-13-5-3-12(4-6-13)15(21)7-8-18(22)23-11-14-10-16(24-20-14)17-2-1-9-25-17/h1-6,9-10H,7-8,11H2