3-[2-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[2-(2H-tetrazol-5-ylmethyl)phenyl]propanoic acid CAS Name: 3-[2-(2H-tetrazol-5-ylmethyl)phenyl]propanoic acid IUPAC Name: 3-[2-(2H-tetrazol-5-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[2-(2H-tetrazol-5-ylmethyl)phenyl]propionic acid Formula: C11H12N4O2 MolecularWeight: 232.23858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC(=O)O)CC2=NNN=N2

Isomeric SMILES

C1=CC=C(C(=C1)CCC(=O)O)CC2=NNN=N2

InChI

InChI=1S/C11H12N4O2/c16-11(17)6-5-8-3-1-2-4-9(8)7-10-12-14-15-13-10/h1-4H,5-7H2,(H,16,17)(H,12,13,14,15)