[(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-4-phenyl-butyl]azanium

Systemtic Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-4-phenyl-butyl]azanium Openeye Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-4-phenyl-butyl]ammonium CAS Name: [(2R)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-4-phenylbutyl]ammonium IUPAC Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-4-phenylbutyl]azanium Traditional Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-4-phenyl-butyl]ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(CCC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@H](CCC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C16H26N2/c1-14-6-5-11-18(13-14)16(12-17)10-9-15-7-3-2-4-8-15/h2-4,7-8,14,16H,5-6,9-13,17H2,1H3/p+2/t14-,16+/m0/s1