phenyl 2,2-dimethyl-3-[2-(5-oxidanylpentyl)-1,2,3,4-tetrazol-5-yl]propanoate

Systemtic Name: phenyl 2,2-dimethyl-3-[2-(5-oxidanylpentyl)-1,2,3,4-tetrazol-5-yl]propanoate Openeye Name: phenyl 3-[2-(5-hydroxypentyl)tetrazol-5-yl]-2,2-dimethyl-propanoate CAS Name: 3-[2-(5-hydroxypentyl)-5-tetrazolyl]-2,2-dimethylpropanoic acid phenyl ester IUPAC Name: phenyl 3-[2-(5-hydroxypentyl)tetrazol-5-yl]-2,2-dimethylpropanoate Traditional Name: 3-[2-(5-hydroxypentyl)tetrazol-5-yl]-2,2-dimethyl-propionic acid phenyl ester Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=NN(N=N1)CCCCCO)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)(CC1=NN(N=N1)CCCCCO)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C17H24N4O3/c1-17(2,16(23)24-14-9-5-3-6-10-14)13-15-18-20-21(19-15)11-7-4-8-12-22/h3,5-6,9-10,22H,4,7-8,11-13H2,1-2H3