4-[4-(1,2,3,4-tetrazol-2-yl)phenyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[4-(1,2,3,4-tetrazol-2-yl)phenyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-[4-(tetrazol-2-yl)phenyl]-1H-1,2,4-triazol-5-one CAS Name: 4-[4-(2-tetrazolyl)phenyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-[4-(tetrazol-2-yl)phenyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-(tetrazol-2-yl)phenyl]-1H-1,2,4-triazol-5-one Formula: C9H7N7O MolecularWeight: 229.19818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NNC2=O)N3N=CN=N3

Isomeric SMILES

C1=CC(=CC=C1N2C=NNC2=O)N3N=CN=N3

InChI

InChI=1S/C9H7N7O/c17-9-13-11-6-15(9)7-1-3-8(4-2-7)16-12-5-10-14-16/h1-6H,(H,13,17)