N-(1,3-benzodioxol-5-yl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4-isobutylphenyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2-methylpropyl)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(4-isobutylphenyl)cinchoninamide Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H24N2O3/c1-17(2)13-18-7-9-19(10-8-18)24-15-22(21-5-3-4-6-23(21)29-24)27(30)28-20-11-12-25-26(14-20)32-16-31-25/h3-12,14-15,17H,13,16H2,1-2H3,(H,28,30)