N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxidanylidene-1-propan-2-yl-quinoline-3-carboxamide

Systemtic Name: N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxidanylidene-1-propan-2-yl-quinoline-3-carboxamide Openeye Name: 1-isopropyl-N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-quinoline-3-carboxamide CAS Name: N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-yl-3-quinolinecarboxamide IUPAC Name: N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-ylquinoline-3-carboxamide Traditional Name: 1-isopropyl-2-keto-N-[(1R,5S)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]quinoline-3-carboxamide Formula: C28H41N3O2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2CCC1CC(C2)NC(=O)C3=CC4=CC=CC=C4N(C3=O)C(C)C

Isomeric SMILES

CCCCCCCCN1[C@@H]2CC[C@H]1CC(C2)NC(=O)C3=CC4=CC=CC=C4N(C3=O)C(C)C

InChI

InChI=1S/C28H41N3O2/c1-4-5-6-7-8-11-16-30-23-14-15-24(30)19-22(18-23)29-27(32)25-17-21-12-9-10-13-26(21)31(20(2)3)28(25)33/h9-10,12-13,17,20,22-24H,4-8,11,14-16,18-19H2,1-3H3,(H,29,32)/t22?,23-,24+