methyl 3-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(tetrazol-1-yl)acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-(1-tetrazolyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(tetrazol-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(tetrazol-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C11H11N5O3 MolecularWeight: 261.23674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C=NN=N2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C=NN=N2

InChI

InChI=1S/C11H11N5O3/c1-19-11(18)8-3-2-4-9(5-8)13-10(17)6-16-7-12-14-15-16/h2-5,7H,6H2,1H3,(H,13,17)