2-(1,3-benzodioxol-5-yl)-N-(2H-1,2,3,4-tetrazol-5-yl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2H-1,2,3,4-tetrazol-5-yl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2H-tetrazol-5-yl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2H-tetrazol-5-yl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2H-tetrazol-5-yl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2H-tetrazol-5-yl)cinchoninamide Formula: C18H12N6O3 MolecularWeight: 360.32628

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=NNN=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=NNN=N5

InChI

InChI=1S/C18H12N6O3/c25-17(20-18-21-23-24-22-18)12-8-14(19-13-4-2-1-3-11(12)13)10-5-6-15-16(7-10)27-9-26-15/h1-8H,9H2,(H2,20,21,22,23,24,25)