(3S)-N-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine Openeye Name: (3S)-N-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine CAS Name: (3S)-N-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-N-methyl-1-phenethyl-3-piperidin-1-iumamine IUPAC Name: (3S)-N-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-N-methyl-1-phenethylpiperidin-1-ium-3-amine Traditional Name: (3-ethyl-1H-imidazol-3-ium-2-yl)methyl-methyl-[(3S)-1-phenethylpiperidin-1-ium-3-yl]amine Formula: C20H32N4+2 MolecularWeight: 328.49488

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC=C1)CN(C)C2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CC[N+]1=C(NC=C1)CN(C)[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H30N4/c1-3-24-15-12-21-20(24)17-22(2)19-10-7-13-23(16-19)14-11-18-8-5-4-6-9-18/h4-6,8-9,12,15,19H,3,7,10-11,13-14,16-17H2,1-2H3/p+2/t19-/m0/s1