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

Systemtic Name: 5-(3,5-dimethyl-2,4-dihydro-1,2,3-triazol-4-yl)-2-methoxy-benzoic acid Openeye Name: 5-(3,5-dimethyl-2,4-dihydrotriazol-4-yl)-2-methoxy-benzoic acid CAS Name: 5-(3,5-dimethyl-2,4-dihydrotriazol-4-yl)-2-methoxybenzoic acid IUPAC Name: 5-(3,5-dimethyl-2,4-dihydrotriazol-4-yl)-2-methoxybenzoic acid Traditional Name: 5-(3,5-dimethyl-2,4-dihydrotriazol-4-yl)-2-methoxy-benzoic acid Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNN(C1C2=CC(=C(C=C2)OC)C(=O)O)C

Isomeric SMILES

CC1=NNN(C1C2=CC(=C(C=C2)OC)C(=O)O)C

InChI

InChI=1S/C12H15N3O3/c1-7-11(15(2)14-13-7)8-4-5-10(18-3)9(6-8)12(16)17/h4-6,11,14H,1-3H3,(H,16,17)