pent-4-ynyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: pent-4-ynyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: pent-4-ynyl 4-(2H-tetrazol-5-yl)benzoate CAS Name: 4-(2H-tetrazol-5-yl)benzoic acid pent-4-ynyl ester IUPAC Name: pent-4-ynyl 4-(2H-tetrazol-5-yl)benzoate Traditional Name: 4-(2H-tetrazol-5-yl)benzoic acid pent-4-ynyl ester Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCOC(=O)C1=CC=C(C=C1)C2=NNN=N2

Isomeric SMILES

C#CCCCOC(=O)C1=CC=C(C=C1)C2=NNN=N2

InChI

InChI=1S/C13H12N4O2/c1-2-3-4-9-19-13(18)11-7-5-10(6-8-11)12-14-16-17-15-12/h1,5-8H,3-4,9H2,(H,14,15,16,17)