3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-phenylpropyl)azanium

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-phenylpropyl)azanium Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-phenylpropyl)ammonium CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl-(3-phenylpropyl)ammonium IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-phenylpropyl)azanium Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-phenylpropyl)ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]CCCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+]CCCC2=CC=CC=C2

InChI

InChI=1S/C18H30N2/c1-17-9-5-6-15-20(17)16-8-14-19-13-7-12-18-10-3-2-4-11-18/h2-4,10-11,17,19H,5-9,12-16H2,1H3/p+2/t17-/m0/s1