4-[5,5-dimethyl-3-[4-(phenylmethyl)piperidin-1-ium-1-ylidene]cyclohexen-1-yl]morpholine iodide

Systemtic Name: 4-[5,5-dimethyl-3-[4-(phenylmethyl)piperidin-1-ium-1-ylidene]cyclohexen-1-yl]morpholine iodide Openeye Name: 4-[3-(4-benzylpiperidin-1-ium-1-ylidene)-5,5-dimethyl-cyclohexen-1-yl]morpholine iodide CAS Name: 4-[5,5-dimethyl-3-[4-(phenylmethyl)-1-piperidin-1-iumylidene]-1-cyclohexenyl]morpholine iodide IUPAC Name: 4-[3-(4-benzylpiperidin-1-ium-1-ylidene)-5,5-dimethylcyclohexen-1-yl]morpholine iodide Traditional Name: 4-[3-(4-benzylpiperidin-1-ium-1-ylidene)-5,5-dimethyl-cyclohexen-1-yl]morpholine iodide Formula: C24H35IN2O MolecularWeight: 494.45197

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=[N+]2CCC(CC2)CC3=CC=CC=C3)C1)N4CCOCC4)C.[I-]

Isomeric SMILES

CC1(CC(=CC(=[N+]2CCC(CC2)CC3=CC=CC=C3)C1)N4CCOCC4)C.[I-]

InChI

InChI=1S/C24H35N2O.HI/c1-24(2)18-22(17-23(19-24)26-12-14-27-15-13-26)25-10-8-21(9-11-25)16-20-6-4-3-5-7-20;/h3-7,17,21H,8-16,18-19H2,1-2H3;1H/q+1;/p-1