5-(methoxymethyl)-1-(4-methylphenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-(methoxymethyl)-1-(4-methylphenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-(methoxymethyl)-1-(p-tolyl)triazole-4-carboxylic acid CAS Name: 5-(methoxymethyl)-1-(4-methylphenyl)-4-triazolecarboxylic acid IUPAC Name: 5-(methoxymethyl)-1-(4-methylphenyl)triazole-4-carboxylic acid Traditional Name: 5-(methoxymethyl)-1-(p-tolyl)triazole-4-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)COC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)COC

InChI

InChI=1S/C12H13N3O3/c1-8-3-5-9(6-4-8)15-10(7-18-2)11(12(16)17)13-14-15/h3-6H,7H2,1-2H3,(H,16,17)