2-[2-(2-carboxyphenyl)-3-phenyl-1H-1,2,3,4-tetrazol-5-yl]benzoic acid

Systemtic Name: 2-[2-(2-carboxyphenyl)-3-phenyl-1H-1,2,3,4-tetrazol-5-yl]benzoic acid Openeye Name: 2-[2-(2-carboxyphenyl)-3-phenyl-1H-tetrazol-5-yl]benzoic acid CAS Name: 2-[2-(2-carboxyphenyl)-3-phenyl-1H-tetrazol-5-yl]benzoic acid IUPAC Name: 2-[2-(2-carboxyphenyl)-3-phenyl-1H-tetrazol-5-yl]benzoic acid Traditional Name: 2-[2-(2-carboxyphenyl)-3-phenyl-1H-tetrazol-5-yl]benzoic acid Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C(NN2C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2N=C(NN2C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C21H16N4O4/c26-20(27)16-11-5-4-10-15(16)19-22-24(14-8-2-1-3-9-14)25(23-19)18-13-7-6-12-17(18)21(28)29/h1-13H,(H,22,23)(H,26,27)(H,28,29)