methyl 4-(5-azido-2H-1,2,3-triazol-4-yl)benzoate

Systemtic Name: methyl 4-(5-azido-2H-1,2,3-triazol-4-yl)benzoate Openeye Name: methyl 4-(5-azido-2H-triazol-4-yl)benzoate CAS Name: 4-(5-azido-2H-triazol-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-azido-2H-triazol-4-yl)benzoate Traditional Name: 4-(5-azido-2H-triazol-4-yl)benzoic acid methyl ester Formula: C10H8N6O2 MolecularWeight: 244.20952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NNN=C2N=[N+]=[N-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NNN=C2N=[N+]=[N-]

InChI

InChI=1S/C10H8N6O2/c1-18-10(17)7-4-2-6(3-5-7)8-9(13-15-11)14-16-12-8/h2-5H,1H3,(H,12,14,16)