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

Systemtic Name: 6-bromanyl-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Openeye Name: 6-bromo-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide CAS Name: 6-bromo-3-[5-(1-methyl-1-piperidin-1-iumyl)pentyl]-1-cyclohexa-2,4-dienone iodide IUPAC Name: 6-bromo-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Traditional Name: 6-bromo-3-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]cyclohexa-2,4-dien-1-one iodide Formula: C17H27BrINO MolecularWeight: 468.21085

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27BrNO.HI/c1-19(12-6-3-7-13-19)11-5-2-4-8-15-9-10-16(18)17(20)14-15;/h9-10,14,16H,2-8,11-13H2,1H3;1H/q+1;/p-1