1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-propan-2-yloxyaniline

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-propan-2-yloxyaniline Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-isopropoxyaniline CAS Name: 1-[(4-bromo-2-fluorophenyl)methyl]-1-ethyl-4-methyl-2-piperidin-1-iumol; 4-propan-2-yloxyaniline IUPAC Name: 1-[(4-bromo-2-fluorophenyl)methyl]-1-ethyl-4-methylpiperidin-1-ium-2-ol; 4-propan-2-yloxyaniline Traditional Name: 1-(4-bromo-2-fluoro-benzyl)-1-ethyl-4-methyl-piperidin-1-ium-2-ol; (4-isopropoxyphenyl)amine Formula: C24H35BrFN2O2+ MolecularWeight: 482.449303

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCC(CC1O)C)CC2=C(C=C(C=C2)Br)F.CC(C)OC1=CC=C(C=C1)N

Isomeric SMILES

CC[N+]1(CCC(CC1O)C)CC2=C(C=C(C=C2)Br)F.CC(C)OC1=CC=C(C=C1)N

InChI

InChI=1S/C15H22BrFNO.C9H13NO/c1-3-18(7-6-11(2)8-15(18)19)10-12-4-5-13(16)9-14(12)17;1-7(2)11-9-5-3-8(10)4-6-9/h4-5,9,11,15,19H,3,6-8,10H2,1-2H3;3-7H,10H2,1-2H3/q+1;