1-[4-(4-bromanyl-2-methyl-phenoxy)butyl]piperidin-1-ium

Systemtic Name: 1-[4-(4-bromanyl-2-methyl-phenoxy)butyl]piperidin-1-ium Openeye Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperidin-1-ium CAS Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperidin-1-ium IUPAC Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperidin-1-ium Traditional Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperidin-1-ium Formula: C16H25BrNO+ MolecularWeight: 327.2798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCC[NH+]2CCCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCC[NH+]2CCCCC2

InChI

InChI=1S/C16H24BrNO/c1-14-13-15(17)7-8-16(14)19-12-6-5-11-18-9-3-2-4-10-18/h7-8,13H,2-6,9-12H2,1H3/p+1