N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(p-tolylmethoxy)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)methoxy]-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide Traditional Name: 2-(4-methylbenzyl)oxy-N-piperonyl-cinchoninamide Formula: C26H22N2O4 MolecularWeight: 426.46388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)COC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H22N2O4/c1-17-6-8-18(9-7-17)15-30-25-13-21(20-4-2-3-5-22(20)28-25)26(29)27-14-19-10-11-23-24(12-19)32-16-31-23/h2-13H,14-16H2,1H3,(H,27,29)