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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H24N2O3/c1-18(11-12-19-7-3-2-4-8-19)28-27(30)22-16-24(29-23-10-6-5-9-21(22)23)20-13-14-25-26(15-20)32-17-31-25/h2-10,13-16,18H,11-12,17H2,1H3,(H,28,30)