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

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]propanoic acid Openeye Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]propanoic acid CAS Name: 2-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]propanoic acid IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]propanoic acid Traditional Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]propionic acid Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1N=C(N=N1)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C(=O)O)N1N=C(N=N1)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C12H14N4O4/c1-7(12(17)18)16-14-11(13-15-16)8-4-5-9(19-2)10(6-8)20-3/h4-7H,1-3H3,(H,17,18)