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

Systemtic Name: ethyl 3-[[5-(4-aminocarbonylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[5-(4-carbamoylphenyl)tetrazol-2-yl]methyl]benzofuran-2-carboxylate CAS Name: 3-[[5-(4-carbamoylphenyl)-2-tetrazolyl]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[5-(4-carbamoylphenyl)tetrazol-2-yl]methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[5-(4-carbamoylphenyl)tetrazol-2-yl]methyl]coumarilic acid ethyl ester Formula: C20H17N5O4 MolecularWeight: 391.38008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N5O4/c1-2-28-20(27)17-15(14-5-3-4-6-16(14)29-17)11-25-23-19(22-24-25)13-9-7-12(8-10-13)18(21)26/h3-10H,2,11H2,1H3,(H2,21,26)