3-(4-ethylphenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: 3-(4-ethylphenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: 3-(4-ethylphenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(4-ethylphenyl)-5-methyl-4-isoxazolecarboxylate IUPAC Name: 3-(4-ethylphenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(4-ethylphenyl)-5-methyl-isoxazole-4-carboxylate Formula: C13H12NO3- MolecularWeight: 230.23928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=C2C(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=C2C(=O)[O-])C

InChI

InChI=1S/C13H13NO3/c1-3-9-4-6-10(7-5-9)12-11(13(15)16)8(2)17-14-12/h4-7H,3H2,1-2H3,(H,15,16)/p-1