N,N-diethyl-5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-amine iodide

Systemtic Name: N,N-diethyl-5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-amine iodide Openeye Name: N,N-diethyl-5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-amine iodide CAS Name: N,N-diethyl-5,5-dimethyl-3-(1-piperidin-1-iumylidene)-1-cyclohexenamine iodide IUPAC Name: N,N-diethyl-5,5-dimethyl-3-piperidin-1-ium-1-ylidenecyclohexen-1-amine iodide Traditional Name: (5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-yl)-diethyl-amine iodide Formula: C17H31IN2 MolecularWeight: 390.34591

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=[N+]2CCCCC2)CC(C1)(C)C.[I-]

Isomeric SMILES

CCN(CC)C1=CC(=[N+]2CCCCC2)CC(C1)(C)C.[I-]

InChI

InChI=1S/C17H31N2.HI/c1-5-18(6-2)15-12-16(14-17(3,4)13-15)19-10-8-7-9-11-19;/h12H,5-11,13-14H2,1-4H3;1H/q+1;/p-1