[4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-pyridin-4-ylquinoline-4-carboxylate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-pyridin-4-ylquinoline-4-carboxylate Openeye Name: [4-(tetrazol-1-yl)phenyl] 2-(4-pyridyl)quinoline-4-carboxylate CAS Name: 2-pyridin-4-yl-4-quinolinecarboxylic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: 2-(4-pyridyl)cinchoninic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C22H14N6O2 MolecularWeight: 394.38556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OC4=CC=C(C=C4)N5C=NN=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OC4=CC=C(C=C4)N5C=NN=N5

InChI

InChI=1S/C22H14N6O2/c29-22(30-17-7-5-16(6-8-17)28-14-24-26-27-28)19-13-21(15-9-11-23-12-10-15)25-20-4-2-1-3-18(19)20/h1-14H