1-(4-fluoranyl-2-methyl-phenyl)-4-[(3S)-3-pyrrolidin-1-ylpiperidin-1-ium-1-yl]piperidine

Systemtic Name: 1-(4-fluoranyl-2-methyl-phenyl)-4-[(3S)-3-pyrrolidin-1-ylpiperidin-1-ium-1-yl]piperidine Openeye Name: 1-(4-fluoro-2-methyl-phenyl)-4-[(3S)-3-pyrrolidin-1-ylpiperidin-1-ium-1-yl]piperidine CAS Name: 1-(4-fluoro-2-methylphenyl)-4-[(3S)-3-(1-pyrrolidinyl)-1-piperidin-1-iumyl]piperidine IUPAC Name: 1-(4-fluoro-2-methylphenyl)-4-[(3S)-3-pyrrolidin-1-ylpiperidin-1-ium-1-yl]piperidine Traditional Name: 1-(4-fluoro-2-methyl-phenyl)-4-[(3S)-3-pyrrolidinopiperidin-1-ium-1-yl]piperidine Formula: C21H33FN3+ MolecularWeight: 346.505223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)N2CCC(CC2)[NH+]3CCCC(C3)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)F)N2CCC(CC2)[NH+]3CCC[C@@H](C3)N4CCCC4

InChI

InChI=1S/C21H32FN3/c1-17-15-18(22)6-7-21(17)24-13-8-19(9-14-24)25-12-4-5-20(16-25)23-10-2-3-11-23/h6-7,15,19-20H,2-5,8-14,16H2,1H3/p+1/t20-/m0/s1