methyl 5-oxidanylidene-1-(4-propan-2-ylphenyl)-2H-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-oxidanylidene-1-(4-propan-2-ylphenyl)-2H-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-(4-isopropylphenyl)-5-oxo-2H-triazole-4-carboxylate CAS Name: 5-oxo-1-(4-propan-2-ylphenyl)-2H-triazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-1-(4-propan-2-ylphenyl)-2H-triazole-4-carboxylate Traditional Name: 5-keto-1-p-cumenyl-2H-triazole-4-carboxylic acid methyl ester Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C(=NN2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C(=NN2)C(=O)OC

InChI

InChI=1S/C13H15N3O3/c1-8(2)9-4-6-10(7-5-9)16-12(17)11(14-15-16)13(18)19-3/h4-8,15H,1-3H3