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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(4-phenylazanylphenyl)quinoline-4-carboxamide Openeye Name: N-(4-anilinophenyl)-2-(1,3-benzodioxol-5-yl)quinoline-4-carboxamide CAS Name: N-(4-anilinophenyl)-2-(1,3-benzodioxol-5-yl)-4-quinolinecarboxamide IUPAC Name: N-(4-anilinophenyl)-2-(1,3-benzodioxol-5-yl)quinoline-4-carboxamide Traditional Name: N-(4-anilinophenyl)-2-(1,3-benzodioxol-5-yl)cinchoninamide Formula: C29H21N3O3 MolecularWeight: 459.49534

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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)NC5=CC=C(C=C5)NC6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=C(C=C5)NC6=CC=CC=C6

InChI

InChI=1S/C29H21N3O3/c33-29(31-22-13-11-21(12-14-22)30-20-6-2-1-3-7-20)24-17-26(32-25-9-5-4-8-23(24)25)19-10-15-27-28(16-19)35-18-34-27/h1-17,30H,18H2,(H,31,33)