(4-methylphenyl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (4-methylphenyl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: p-tolylmethyl 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid (4-methylbenzyl) ester Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)N3C=NN=N3

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)N3C=NN=N3

InChI

InChI=1S/C16H14N4O2/c1-12-5-7-13(8-6-12)10-22-16(21)14-3-2-4-15(9-14)20-11-17-18-19-20/h2-9,11H,10H2,1H3