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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methylanilino)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methylanilino)-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methylanilino)quinoline-4-carboxamide Traditional Name: 2-(o-toluidino)-N-piperonyl-cinchoninamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O3/c1-16-6-2-4-8-20(16)27-24-13-19(18-7-3-5-9-21(18)28-24)25(29)26-14-17-10-11-22-23(12-17)31-15-30-22/h2-13H,14-15H2,1H3,(H,26,29)(H,27,28)