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

Systemtic Name: methyl 3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]benzoate Openeye Name: methyl 3-[(5-phenyltetrazol-2-yl)methyl]benzoate CAS Name: 3-[(5-phenyl-2-tetrazolyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-phenyltetrazol-2-yl)methyl]benzoate Traditional Name: 3-[(5-phenyltetrazol-2-yl)methyl]benzoic acid methyl ester Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2N=C(N=N2)C3=CC=CC=C3

InChI

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