ethyl 3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(5-phenyltetrazol-2-yl)methyl]benzofuran-2-carboxylate CAS Name: 3-[(5-phenyl-2-tetrazolyl)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-phenyltetrazol-2-yl)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(5-phenyltetrazol-2-yl)methyl]coumarilic acid ethyl ester Formula: C19H16N4O3 MolecularWeight: 348.35534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3N=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3N=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3/c1-2-25-19(24)17-15(14-10-6-7-11-16(14)26-17)12-23-21-18(20-22-23)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3