3-(3-cyanophenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-(3-cyanophenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 3-(3-cyanophenyl)-5-methyl-4H-isoxazole-5-carboxylic acid CAS Name: 3-(3-cyanophenyl)-5-methyl-4H-isoxazole-5-carboxylic acid IUPAC Name: 3-(3-cyanophenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 3-(3-cyanophenyl)-5-methyl-2-isoxazoline-5-carboxylic acid Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)C2=CC=CC(=C2)C#N)C(=O)O

Isomeric SMILES

CC1(CC(=NO1)C2=CC=CC(=C2)C#N)C(=O)O

InChI

InChI=1S/C12H10N2O3/c1-12(11(15)16)6-10(14-17-12)9-4-2-3-8(5-9)7-13/h2-5H,6H2,1H3,(H,15,16)