1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-propan-2-yloxyaniline

Systemtic Name: 1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-propan-2-yloxyaniline Openeye Name: 1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-isopropoxyaniline CAS Name: 1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methyl-2-piperidin-1-iumol; 4-propan-2-yloxyaniline IUPAC Name: 1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methylpiperidin-1-ium-2-ol; 4-propan-2-yloxyaniline Traditional Name: 1-[bis(4-fluorophenyl)methyl]-1-ethyl-4-methyl-piperidin-1-ium-2-ol; (4-isopropoxyphenyl)amine Formula: C30H39F2N2O2+ MolecularWeight: 497.639666

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCC(CC1O)C)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.CC(C)OC1=CC=C(C=C1)N

Isomeric SMILES

CC[N+]1(CCC(CC1O)C)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.CC(C)OC1=CC=C(C=C1)N

InChI

InChI=1S/C21H26F2NO.C9H13NO/c1-3-24(13-12-15(2)14-20(24)25)21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17;1-7(2)11-9-5-3-8(10)4-6-9/h4-11,15,20-21,25H,3,12-14H2,1-2H3;3-7H,10H2,1-2H3/q+1;