N-(1-azabicyclo[2.2.2]octan-3-yl)-7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxamide Openeye Name: 7-chloro-2,2-dimethyl-N-quinuclidin-3-yl-4,5-dihydro-3H-1-benzoxepine-9-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-9-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxamide Traditional Name: 7-chloro-2,2-dimethyl-N-quinuclidin-3-yl-4,5-dihydro-3H-1-benzoxepin-9-carboxamide Formula: C20H27ClN2O2 MolecularWeight: 362.89358

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2=C(O1)C(=CC(=C2)Cl)C(=O)NC3CN4CCC3CC4)C

Isomeric SMILES

CC1(CCCC2=C(O1)C(=CC(=C2)Cl)C(=O)NC3CN4CCC3CC4)C

InChI

InChI=1S/C20H27ClN2O2/c1-20(2)7-3-4-14-10-15(21)11-16(18(14)25-20)19(24)22-17-12-23-8-5-13(17)6-9-23/h10-11,13,17H,3-9,12H2,1-2H3,(H,22,24)