2-[3-(4-fluorophenyl)-5-methyl-1-piperidin-4-yl-indol-1-ium-1-yl]ethanamine

Systemtic Name: 2-[3-(4-fluorophenyl)-5-methyl-1-piperidin-4-yl-indol-1-ium-1-yl]ethanamine Openeye Name: 2-[3-(4-fluorophenyl)-5-methyl-1-(4-piperidyl)indol-1-ium-1-yl]ethanamine CAS Name: 2-[3-(4-fluorophenyl)-5-methyl-1-(4-piperidinyl)-1-indol-1-iumyl]ethanamine IUPAC Name: 2-[3-(4-fluorophenyl)-5-methyl-1-piperidin-4-ylindol-1-ium-1-yl]ethanamine Traditional Name: 2-[3-(4-fluorophenyl)-5-methyl-1-(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)[N+](C=C2C3=CC=C(C=C3)F)(CCN)C4CCNCC4

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](C=C2C3=CC=C(C=C3)F)(CCN)C4CCNCC4

InChI

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