ethyl 4-[2-(5-pyridin-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(5-pyridin-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-(3-pyridyl)tetrazol-2-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[5-(3-pyridinyl)-2-tetrazolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-pyridin-3-yltetrazol-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-[5-(3-pyridyl)tetrazol-2-yl]acetyl]amino]benzoic acid ethyl ester Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CN=CC=C3

InChI

InChI=1S/C17H16N6O3/c1-2-26-17(25)12-5-7-14(8-6-12)19-15(24)11-23-21-16(20-22-23)13-4-3-9-18-10-13/h3-10H,2,11H2,1H3,(H,19,24)