6-methoxy-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide

Systemtic Name: 6-methoxy-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Openeye Name: 6-methoxy-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide CAS Name: 6-methoxy-3-[5-(1-methyl-1-piperidin-1-iumyl)pentyl]-1-cyclohexa-2,4-dienone iodide IUPAC Name: 6-methoxy-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Traditional Name: 6-methoxy-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Formula: C18H30INO2 MolecularWeight: 419.34077

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCCCCC2=CC(=O)C(C=C2)OC.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)CCCCCC2=CC(=O)C(C=C2)OC.[I-]

InChI

InChI=1S/C18H30NO2.HI/c1-19(13-7-4-8-14-19)12-6-3-5-9-16-10-11-18(21-2)17(20)15-16;/h10-11,15,18H,3-9,12-14H2,1-2H3;1H/q+1;/p-1