ethyl (3E)-3-(4-methoxyphenyl)-3-[3-(4-methoxyphenyl)-5-oxidanylidene-1,2-oxazol-4-ylidene]propanoate

Systemtic Name: ethyl (3E)-3-(4-methoxyphenyl)-3-[3-(4-methoxyphenyl)-5-oxidanylidene-1,2-oxazol-4-ylidene]propanoate Openeye Name: ethyl (3E)-3-(4-methoxyphenyl)-3-[3-(4-methoxyphenyl)-5-oxo-isoxazol-4-ylidene]propanoate CAS Name: (3E)-3-(4-methoxyphenyl)-3-[3-(4-methoxyphenyl)-5-oxo-4-isoxazolylidene]propanoic acid ethyl ester IUPAC Name: ethyl (3E)-3-(4-methoxyphenyl)-3-[3-(4-methoxyphenyl)-5-oxo-1,2-oxazol-4-ylidene]propanoate Traditional Name: (3E)-3-[5-keto-3-(4-methoxyphenyl)-2-isoxazolin-4-ylidene]-3-(4-methoxyphenyl)propionic acid ethyl ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C1C(=NOC1=O)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C/C(=C\1/C(=NOC1=O)C2=CC=C(C=C2)OC)/C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21NO6/c1-4-28-19(24)13-18(14-5-9-16(26-2)10-6-14)20-21(23-29-22(20)25)15-7-11-17(27-3)12-8-15/h5-12H,4,13H2,1-3H3/b20-18+