(3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidazo[2,1-a]isoindol-1-ium-5-one

Systemtic Name: (3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidazo[2,1-a]isoindol-1-ium-5-one Openeye Name: (3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidazo[2,1-a]isoindol-1-ium-5-one CAS Name: (3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidazo[2,1-a]isoindol-1-ium-5-one IUPAC Name: (3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidazo[2,1-a]isoindol-1-ium-5-one Traditional Name: (3S,9bR)-1-cyclohexyl-3,9b-dimethyl-2,3-dihydro-1H-imidaz[2,1-a]isoindol-1-ium-5-one Formula: C18H25N2O+ MolecularWeight: 285.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](C2(N1C(=O)C3=CC=CC=C32)C)C4CCCCC4

Isomeric SMILES

C[C@H]1C[NH+]([C@]2(N1C(=O)C3=CC=CC=C32)C)C4CCCCC4

InChI

InChI=1S/C18H24N2O/c1-13-12-19(14-8-4-3-5-9-14)18(2)16-11-7-6-10-15(16)17(21)20(13)18/h6-7,10-11,13-14H,3-5,8-9,12H2,1-2H3/p+1/t13-,18-/m0/s1