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

Systemtic Name: 3-[[3-(1,2,3,4-tetrazol-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylate Openeye Name: 3-[[3-(tetrazol-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylate CAS Name: 3-[oxo-[3-(1-tetrazolyl)anilino]methyl]-2-pyrazinecarboxylate IUPAC Name: 3-[[3-(tetrazol-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylate Traditional Name: 3-[[3-(tetrazol-1-yl)phenyl]carbamoyl]pyrazinate Formula: C13H8N7O3- MolecularWeight: 310.24772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)[O-])N3C=NN=N3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)[O-])N3C=NN=N3

InChI

InChI=1S/C13H9N7O3/c21-12(10-11(13(22)23)15-5-4-14-10)17-8-2-1-3-9(6-8)20-7-16-18-19-20/h1-7H,(H,17,21)(H,22,23)/p-1