N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-phenylphenyl)cinchoninamide Formula: C31H23N3O3 MolecularWeight: 485.53262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C4=CC=CC=C4)/C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C31H23N3O3/c1-20(24-15-16-29-30(17-24)37-19-36-29)33-34-31(35)26-18-28(32-27-10-6-5-9-25(26)27)23-13-11-22(12-14-23)21-7-3-2-4-8-21/h2-18H,19H2,1H3,(H,34,35)/b33-20+