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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N,N-dicyclohexyl-quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N,N-dicyclohexyl-quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N,N-dicyclohexyl-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N,N-dicyclohexylquinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N,N-dicyclohexyl-cinchoninamide Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H32N2O3/c32-29(31(21-9-3-1-4-10-21)22-11-5-2-6-12-22)24-18-26(30-25-14-8-7-13-23(24)25)20-15-16-27-28(17-20)34-19-33-27/h7-8,13-18,21-22H,1-6,9-12,19H2