1-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]pyrazole-3-carboxylate

Systemtic Name: 1-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]pyrazole-3-carboxylate Openeye Name: 1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxylate CAS Name: 1-[(5-phenyl-2-tetrazolyl)methyl]-3-pyrazolecarboxylate IUPAC Name: 1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxylate Traditional Name: 1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxylate Formula: C12H9N6O2- MolecularWeight: 269.23886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CN3C=CC(=N3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CN3C=CC(=N3)C(=O)[O-]

InChI

InChI=1S/C12H10N6O2/c19-12(20)10-6-7-17(14-10)8-18-15-11(13-16-18)9-4-2-1-3-5-9/h1-7H,8H2,(H,19,20)/p-1