[(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-4-phenyl-butyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-4-phenyl-butyl]azanium Openeye Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-4-phenyl-butyl]ammonium CAS Name: [(2R)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-4-phenylbutyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-4-phenylbutyl]azanium Traditional Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-4-phenyl-butyl]ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C(CCC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@H](CCC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C17H28N2/c1-2-16-10-6-7-13-19(16)17(14-18)12-11-15-8-4-3-5-9-15/h3-5,8-9,16-17H,2,6-7,10-14,18H2,1H3/p+2/t16-,17+/m0/s1