2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methyl-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methyl-phenyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methyl-phenyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methylphenyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-6-methyl-phenyl)cinchoninamide Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C26H22N2O3/c1-3-17-8-6-7-16(2)25(17)28-26(29)20-14-22(27-21-10-5-4-9-19(20)21)18-11-12-23-24(13-18)31-15-30-23/h4-14H,3,15H2,1-2H3,(H,28,29)