2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[3-(diethylamino)propyl]cinchoninamide Formula: C24H27N3O3 MolecularWeight: 405.48948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O3/c1-3-27(4-2)13-7-12-25-24(28)19-15-21(26-20-9-6-5-8-18(19)20)17-10-11-22-23(14-17)30-16-29-22/h5-6,8-11,14-15H,3-4,7,12-13,16H2,1-2H3,(H,25,28)