4-[2-[(2-methylphenyl)methyl]-1,2,3,4-tetrazol-5-yl]benzoate

Systemtic Name: 4-[2-[(2-methylphenyl)methyl]-1,2,3,4-tetrazol-5-yl]benzoate Openeye Name: 4-[2-(o-tolylmethyl)tetrazol-5-yl]benzoate CAS Name: 4-[2-[(2-methylphenyl)methyl]-5-tetrazolyl]benzoate IUPAC Name: 4-[2-[(2-methylphenyl)methyl]tetrazol-5-yl]benzoate Traditional Name: 4-[2-(2-methylbenzyl)tetrazol-5-yl]benzoate Formula: C16H13N4O2- MolecularWeight: 293.30002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2N=C(N=N2)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2N=C(N=N2)C3=CC=C(C=C3)C(=O)[O-]

InChI

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