3-[3-(1,2,3,4-tetrazol-1-yl)propanoylamino]benzoic acid

Systemtic Name: 3-[3-(1,2,3,4-tetrazol-1-yl)propanoylamino]benzoic acid Openeye Name: 3-[3-(tetrazol-1-yl)propanoylamino]benzoic acid CAS Name: 3-[[1-oxo-3-(1-tetrazolyl)propyl]amino]benzoic acid IUPAC Name: 3-[3-(tetrazol-1-yl)propanoylamino]benzoic acid Traditional Name: 3-[3-(tetrazol-1-yl)propanoylamino]benzoic acid Formula: C11H11N5O3 MolecularWeight: 261.23674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCN2C=NN=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCN2C=NN=N2)C(=O)O

InChI

InChI=1S/C11H11N5O3/c17-10(4-5-16-7-12-14-15-16)13-9-3-1-2-8(6-9)11(18)19/h1-3,6-7H,4-5H2,(H,13,17)(H,18,19)