[(2S)-2-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2S)-2-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2S)-2-[(1-ethyl-4-piperidin-1-iumyl)amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2S)-2-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(C[NH+](C)C)C2=CC=CC=C2

Isomeric SMILES

CC[NH+]1CCC(CC1)N[C@H](C[NH+](C)C)C2=CC=CC=C2

InChI

InChI=1S/C17H29N3/c1-4-20-12-10-16(11-13-20)18-17(14-19(2)3)15-8-6-5-7-9-15/h5-9,16-18H,4,10-14H2,1-3H3/p+2/t17-/m1/s1