N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloranyl-8-methyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloranyl-8-methyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-8-methyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-8-methyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-8-methyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-8-methyl-2-(2-pyridyl)cinchoninamide Formula: C25H20ClN3O3 MolecularWeight: 445.8976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)C5=CC=CC=N5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)C5=CC=CC=N5)Cl

InChI

InChI=1S/C25H20ClN3O3/c1-14-19(26)8-7-17-18(12-21(29-24(14)17)20-5-3-4-10-27-20)25(30)28-15(2)16-6-9-22-23(11-16)32-13-31-22/h3-12,15H,13H2,1-2H3,(H,28,30)