1-[(2R)-5-(4-fluoranyl-3-methyl-phenyl)pentan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2R)-5-(4-fluoranyl-3-methyl-phenyl)pentan-2-yl]piperazin-4-ium Openeye Name: 1-[(1R)-4-(4-fluoro-3-methyl-phenyl)-1-methyl-butyl]piperazin-4-ium CAS Name: 1-[(2R)-5-(4-fluoro-3-methylphenyl)pentan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2R)-5-(4-fluoro-3-methylphenyl)pentan-2-yl]piperazin-4-ium Traditional Name: 1-[(1R)-4-(4-fluoro-3-methyl-phenyl)-1-methyl-butyl]piperazin-4-ium Formula: C16H26FN2+ MolecularWeight: 265.389443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCCC(C)N2CC[NH2+]CC2)F

Isomeric SMILES

CC1=C(C=CC(=C1)CCC[C@@H](C)N2CC[NH2+]CC2)F

InChI

InChI=1S/C16H25FN2/c1-13-12-15(6-7-16(13)17)5-3-4-14(2)19-10-8-18-9-11-19/h6-7,12,14,18H,3-5,8-11H2,1-2H3/p+1/t14-/m1/s1