3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid Openeye Name: 3-(3,4-dimethylphenyl)-4,5-dihydroisoxazole-5-carboxylic acid CAS Name: 3-(3,4-dimethylphenyl)-4,5-dihydroisoxazole-5-carboxylic acid IUPAC Name: 3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid Traditional Name: 3-(3,4-dimethylphenyl)-2-isoxazoline-5-carboxylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(C2)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(C2)C(=O)O)C

InChI

InChI=1S/C12H13NO3/c1-7-3-4-9(5-8(7)2)10-6-11(12(14)15)16-13-10/h3-5,11H,6H2,1-2H3,(H,14,15)