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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-pentyl-quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-pentyl-quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-pentyl-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-pentylquinoline-4-carboxamide Traditional Name: N-amyl-2-(1,3-benzodioxol-5-yl)cinchoninamide Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O3/c1-2-3-6-11-23-22(25)17-13-19(24-18-8-5-4-7-16(17)18)15-9-10-20-21(12-15)27-14-26-20/h4-5,7-10,12-13H,2-3,6,11,14H2,1H3,(H,23,25)