2-(5-decyl-1,2,3,4-tetrazol-2-yl)-2-phenyl-ethanoate

Systemtic Name: 2-(5-decyl-1,2,3,4-tetrazol-2-yl)-2-phenyl-ethanoate Openeye Name: 2-(5-decyltetrazol-2-yl)-2-phenyl-acetate CAS Name: 2-(5-decyl-2-tetrazolyl)-2-phenylacetate IUPAC Name: 2-(5-decyltetrazol-2-yl)-2-phenylacetate Traditional Name: 2-(5-decyltetrazol-2-yl)-2-phenyl-acetate Formula: C19H27N4O2- MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=NN(N=N1)C(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCC1=NN(N=N1)C(C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C19H28N4O2/c1-2-3-4-5-6-7-8-12-15-17-20-22-23(21-17)18(19(24)25)16-13-10-9-11-14-16/h9-11,13-14,18H,2-8,12,15H2,1H3,(H,24,25)/p-1