2-[5-(4-propoxyphenyl)-1,2,3,4-tetrazol-2-yl]propanoic acid

Systemtic Name: 2-[5-(4-propoxyphenyl)-1,2,3,4-tetrazol-2-yl]propanoic acid Openeye Name: 2-[5-(4-propoxyphenyl)tetrazol-2-yl]propanoic acid CAS Name: 2-[5-(4-propoxyphenyl)-2-tetrazolyl]propanoic acid IUPAC Name: 2-[5-(4-propoxyphenyl)tetrazol-2-yl]propanoic acid Traditional Name: 2-[5-(4-propoxyphenyl)tetrazol-2-yl]propionic acid Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)C(=O)O

InChI

InChI=1S/C13H16N4O3/c1-3-8-20-11-6-4-10(5-7-11)12-14-16-17(15-12)9(2)13(18)19/h4-7,9H,3,8H2,1-2H3,(H,18,19)