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

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenyltetrazol-5-one Traditional Name: 1-(2,5-dimethylbenzyl)-4-phenyl-tetrazol-5-one Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C(=O)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C(=O)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H16N4O/c1-12-8-9-13(2)14(10-12)11-19-16(21)20(18-17-19)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3