(4-cyanophenyl) 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate

Systemtic Name: (4-cyanophenyl) 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate Openeye Name: (4-cyanophenyl) 5-(3,4-dimethylphenyl)isoxazole-3-carboxylate CAS Name: 5-(3,4-dimethylphenyl)-3-isoxazolecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate Traditional Name: 5-(3,4-dimethylphenyl)isoxazole-3-carboxylic acid (4-cyanophenyl) ester Formula: C19H14N2O3 MolecularWeight: 318.32606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)OC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)OC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C19H14N2O3/c1-12-3-6-15(9-13(12)2)18-10-17(21-24-18)19(22)23-16-7-4-14(11-20)5-8-16/h3-10H,1-2H3