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

Systemtic Name: 2-[5-(phenylmethyl)-1,2,3,4-tetrazol-2-yl]propanoic acid Openeye Name: 2-(5-benzyltetrazol-2-yl)propanoic acid CAS Name: 2-[5-(phenylmethyl)-2-tetrazolyl]propanoic acid IUPAC Name: 2-(5-benzyltetrazol-2-yl)propanoic acid Traditional Name: 2-(5-benzyltetrazol-2-yl)propionic acid Formula: C11H12N4O2 MolecularWeight: 232.23858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1N=C(N=N1)CC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)N1N=C(N=N1)CC2=CC=CC=C2

InChI

InChI=1S/C11H12N4O2/c1-8(11(16)17)15-13-10(12-14-15)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,16,17)