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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-homopiperonyl-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C28H26N2O6 MolecularWeight: 486.51584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H26N2O6/c1-32-25-13-18(14-26(33-2)27(25)34-3)22-15-20(19-6-4-5-7-21(19)30-22)28(31)29-11-10-17-8-9-23-24(12-17)36-16-35-23/h4-9,12-15H,10-11,16H2,1-3H3,(H,29,31)