methyl 2-phenyl-1,2,3,4-tetrazole-5-carboxylate

Systemtic Name: methyl 2-phenyl-1,2,3,4-tetrazole-5-carboxylate Openeye Name: methyl 2-phenyltetrazole-5-carboxylate CAS Name: 2-phenyl-5-tetrazolecarboxylic acid methyl ester IUPAC Name: methyl 2-phenyltetrazole-5-carboxylate Traditional Name: 2-phenyltetrazole-5-carboxylic acid methyl ester Formula: C9H8N4O2 MolecularWeight: 204.18542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(N=N1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NN(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C9H8N4O2/c1-15-9(14)8-10-12-13(11-8)7-5-3-2-4-6-7/h2-6H,1H3