2-[[5-[4-[methyl(pyridin-2-yl)carbamoyl]phenyl]-1,2,3,4-tetrazol-2-yl]methyl]benzoic acid

Systemtic Name: 2-[[5-[4-[methyl(pyridin-2-yl)carbamoyl]phenyl]-1,2,3,4-tetrazol-2-yl]methyl]benzoic acid Openeye Name: 2-[[5-[4-[methyl(2-pyridyl)carbamoyl]phenyl]tetrazol-2-yl]methyl]benzoic acid CAS Name: 2-[[5-[4-[[methyl(2-pyridinyl)amino]-oxomethyl]phenyl]-2-tetrazolyl]methyl]benzoic acid IUPAC Name: 2-[[5-[4-[methyl(pyridin-2-yl)carbamoyl]phenyl]tetrazol-2-yl]methyl]benzoic acid Traditional Name: 2-[[5-[4-[methyl(2-pyridyl)carbamoyl]phenyl]tetrazol-2-yl]methyl]benzoic acid Formula: C22H18N6O3 MolecularWeight: 414.41672

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)C3=NN(N=N3)CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)C3=NN(N=N3)CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H18N6O3/c1-27(19-8-4-5-13-23-19)21(29)16-11-9-15(10-12-16)20-24-26-28(25-20)14-17-6-2-3-7-18(17)22(30)31/h2-13H,14H2,1H3,(H,30,31)