[4-(1,2,3,4-tetrazol-1-yl)phenyl] pyrazine-2-carboxylate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] pyrazine-2-carboxylate Openeye Name: [4-(tetrazol-1-yl)phenyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C12H8N6O2 MolecularWeight: 268.23092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NN=N2)OC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC(=CC=C1N2C=NN=N2)OC(=O)C3=NC=CN=C3

InChI

InChI=1S/C12H8N6O2/c19-12(11-7-13-5-6-14-11)20-10-3-1-9(2-4-10)18-8-15-16-17-18/h1-8H