1-phenyl-4-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-phenyl-4-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrazol-5-one Openeye Name: 1-phenyl-4-[(4-pyrazol-1-ylphenyl)methyl]tetrazol-5-one CAS Name: 1-phenyl-4-[[4-(1-pyrazolyl)phenyl]methyl]-5-tetrazolone IUPAC Name: 1-phenyl-4-[(4-pyrazol-1-ylphenyl)methyl]tetrazol-5-one Traditional Name: 1-phenyl-4-(4-pyrazol-1-ylbenzyl)tetrazol-5-one Formula: C17H14N6O MolecularWeight: 318.33266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C17H14N6O/c24-17-22(19-20-23(17)16-5-2-1-3-6-16)13-14-7-9-15(10-8-14)21-12-4-11-18-21/h1-12H,13H2