ethyl 4-(5-phenyl-1,2,3,4-tetrazol-1-yl)butanoate

Systemtic Name: ethyl 4-(5-phenyl-1,2,3,4-tetrazol-1-yl)butanoate Openeye Name: ethyl 4-(5-phenyltetrazol-1-yl)butanoate CAS Name: 4-(5-phenyl-1-tetrazolyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(5-phenyltetrazol-1-yl)butanoate Traditional Name: 4-(5-phenyltetrazol-1-yl)butyric acid ethyl ester Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=NN=N1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCCN1C(=NN=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H16N4O2/c1-2-19-12(18)9-6-10-17-13(14-15-16-17)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3