(5-phenyl-1,2-oxazol-3-yl)methyl 4-(4-ethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 4-(4-ethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 4-(4-ethoxyphenyl)-4-oxo-butanoate CAS Name: 4-(4-ethoxyphenyl)-4-oxobutanoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 4-(4-ethoxyphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-p-phenetyl-butyric acid (5-phenylisoxazol-3-yl)methyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO5/c1-2-26-19-10-8-16(9-11-19)20(24)12-13-22(25)27-15-18-14-21(28-23-18)17-6-4-3-5-7-17/h3-11,14H,2,12-13,15H2,1H3