2-[1-(4-fluorophenyl)-6-methyl-2-piperidin-4-yl-indol-1-ium-1-yl]ethanamine

Systemtic Name: 2-[1-(4-fluorophenyl)-6-methyl-2-piperidin-4-yl-indol-1-ium-1-yl]ethanamine Openeye Name: 2-[1-(4-fluorophenyl)-6-methyl-2-(4-piperidyl)indol-1-ium-1-yl]ethanamine CAS Name: 2-[1-(4-fluorophenyl)-6-methyl-2-(4-piperidinyl)-1-indol-1-iumyl]ethanamine IUPAC Name: 2-[1-(4-fluorophenyl)-6-methyl-2-piperidin-4-ylindol-1-ium-1-yl]ethanamine Traditional Name: 2-[1-(4-fluorophenyl)-6-methyl-2-(4-piperidyl)indol-1-ium-1-yl]ethylamine Formula: C22H27FN3+ MolecularWeight: 352.468283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C([N+]2(CCN)C3=CC=C(C=C3)F)C4CCNCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C([N+]2(CCN)C3=CC=C(C=C3)F)C4CCNCC4

InChI

InChI=1S/C22H27FN3/c1-16-2-3-18-15-22(17-8-11-25-12-9-17)26(13-10-24,21(18)14-16)20-6-4-19(23)5-7-20/h2-7,14-15,17,25H,8-13,24H2,1H3/q+1