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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N,N-bis(phenylmethyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N,N-dibenzyl-quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N,N-bis(phenylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N,N-dibenzylquinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N,N-dibenzyl-cinchoninamide Formula: C31H24N2O3 MolecularWeight: 472.53386

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)N(CC5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)N(CC5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C31H24N2O3/c34-31(33(19-22-9-3-1-4-10-22)20-23-11-5-2-6-12-23)26-18-28(32-27-14-8-7-13-25(26)27)24-15-16-29-30(17-24)36-21-35-29/h1-18H,19-21H2