2-(2,4-dichlorophenyl)-N-pyridin-1-ium-3-yl-quinoline-4-carboxamide

Systemtic Name: 2-(2,4-dichlorophenyl)-N-pyridin-1-ium-3-yl-quinoline-4-carboxamide Openeye Name: 2-(2,4-dichlorophenyl)-N-pyridin-1-ium-3-yl-quinoline-4-carboxamide CAS Name: 2-(2,4-dichlorophenyl)-N-(3-pyridin-1-iumyl)-4-quinolinecarboxamide IUPAC Name: 2-(2,4-dichlorophenyl)-N-pyridin-1-ium-3-ylquinoline-4-carboxamide Traditional Name: 2-(2,4-dichlorophenyl)-N-pyridin-1-ium-3-yl-cinchoninamide Formula: C21H14Cl2N3O+ MolecularWeight: 395.26136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)NC4=C[NH+]=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)NC4=C[NH+]=CC=C4

InChI

InChI=1S/C21H13Cl2N3O/c22-13-7-8-16(18(23)10-13)20-11-17(15-5-1-2-6-19(15)26-20)21(27)25-14-4-3-9-24-12-14/h1-12H,(H,25,27)/p+1