N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(4-isopropylphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-propan-2-ylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Traditional Name: 2-p-cumenyl-N-[(E)-piperonylideneamino]cinchoninamide Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H23N3O3/c1-17(2)19-8-10-20(11-9-19)24-14-22(21-5-3-4-6-23(21)29-24)27(31)30-28-15-18-7-12-25-26(13-18)33-16-32-25/h3-15,17H,16H2,1-2H3,(H,30,31)/b28-15+