methyl 4-[(Z)-[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[2-(4-tert-butylphenyl)-5-oxo-oxazol-4-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[2-(4-tert-butylphenyl)-5-oxo-4-oxazolylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[2-(4-tert-butylphenyl)-5-keto-2-oxazolin-4-ylidene]methyl]benzoic acid methyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=N/C(=C\C3=CC=C(C=C3)C(=O)OC)/C(=O)O2

InChI

InChI=1S/C22H21NO4/c1-22(2,3)17-11-9-15(10-12-17)19-23-18(21(25)27-19)13-14-5-7-16(8-6-14)20(24)26-4/h5-13H,1-4H3/b18-13-