2-[5-(4-methyl-3-pyrazol-1-yl-phenyl)-1,2,3,4-tetrazol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(4-methyl-3-pyrazol-1-yl-phenyl)-1,2,3,4-tetrazol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-methyl-3-pyrazol-1-yl-phenyl)tetrazol-2-yl]acetic acid CAS Name: 2-[5-[4-methyl-3-(1-pyrazolyl)phenyl]-2-tetrazolyl]acetic acid IUPAC Name: 2-[5-(4-methyl-3-pyrazol-1-ylphenyl)tetrazol-2-yl]acetic acid Traditional Name: 2-[5-(4-methyl-3-pyrazol-1-yl-phenyl)tetrazol-2-yl]acetic acid Formula: C13H12N6O2 MolecularWeight: 284.27338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)O)N3C=CC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)O)N3C=CC=N3

InChI

InChI=1S/C13H12N6O2/c1-9-3-4-10(7-11(9)18-6-2-5-14-18)13-15-17-19(16-13)8-12(20)21/h2-7H,8H2,1H3,(H,20,21)