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

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]butanoic acid Openeye Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]butanoic acid CAS Name: 2-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]butanoic acid IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]butanoic acid Traditional Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]butyric acid Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O4/c1-4-9(13(18)19)17-15-12(14-16-17)8-5-6-10(20-2)11(7-8)21-3/h5-7,9H,4H2,1-3H3,(H,18,19)