2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-methyl-propanoate

Systemtic Name: 2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-methyl-propanoate Openeye Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methyl-propanoate CAS Name: 2-[5-(4-butoxyphenyl)-2-tetrazolyl]-2-methylpropanoate IUPAC Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methylpropanoate Traditional Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methyl-propionate Formula: C15H19N4O3- MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)(C)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)(C)C(=O)[O-]

InChI

InChI=1S/C15H20N4O3/c1-4-5-10-22-12-8-6-11(7-9-12)13-16-18-19(17-13)15(2,3)14(20)21/h6-9H,4-5,10H2,1-3H3,(H,20,21)/p-1