N-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]-1-phenethyl-piperidin-1-ium-4-amine

Systemtic Name: N-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]-1-phenethyl-piperidin-1-ium-4-amine Openeye Name: N-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]-1-phenethyl-piperidin-1-ium-4-amine CAS Name: N-[2-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]ethyl]-1-phenethyl-4-piperidin-1-iumamine IUPAC Name: N-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]-1-phenethylpiperidin-1-ium-4-amine Traditional Name: 2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl-(1-phenethylpiperidin-1-ium-4-yl)amine Formula: C20H35N3+2 MolecularWeight: 317.512

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1CCNC2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC[C@H]1CCNC2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H33N3/c1-22-14-5-8-20(22)9-13-21-19-11-16-23(17-12-19)15-10-18-6-3-2-4-7-18/h2-4,6-7,19-21H,5,8-17H2,1H3/p+2/t20-/m0/s1