2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid Traditional Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzoic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)COC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=NN=C(N1C)COC2=CC=CC=C2C(=O)O

InChI

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