4-[4,5-bis(ethoxycarbonyl)-1,2,3-triazol-1-yl]benzoic acid

Systemtic Name: 4-[4,5-bis(ethoxycarbonyl)-1,2,3-triazol-1-yl]benzoic acid Openeye Name: 4-[4,5-bis(ethoxycarbonyl)triazol-1-yl]benzoic acid CAS Name: 4-[4,5-bis(ethoxycarbonyl)-1-triazolyl]benzoic acid IUPAC Name: 4-[4,5-bis(ethoxycarbonyl)triazol-1-yl]benzoic acid Traditional Name: 4-(4,5-dicarbethoxytriazol-1-yl)benzoic acid Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)C(=O)O)C(=O)OCC

InChI

InChI=1S/C15H15N3O6/c1-3-23-14(21)11-12(15(22)24-4-2)18(17-16-11)10-7-5-9(6-8-10)13(19)20/h5-8H,3-4H2,1-2H3,(H,19,20)