(2S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-ethyl-piperidin-1-ium

Systemtic Name: (2S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-ethyl-piperidin-1-ium Openeye Name: (2S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-ethyl-piperidin-1-ium CAS Name: (2S)-1-[(3-ethoxy-4-methoxyphenyl)methyl]-2-ethylpiperidin-1-ium IUPAC Name: (2S)-1-[(3-ethoxy-4-methoxyphenyl)methyl]-2-ethylpiperidin-1-ium Traditional Name: (2S)-1-(3-ethoxy-4-methoxy-benzyl)-2-ethyl-piperidin-1-ium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=CC(=C(C=C2)OC)OCC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=CC(=C(C=C2)OC)OCC

InChI

InChI=1S/C17H27NO2/c1-4-15-8-6-7-11-18(15)13-14-9-10-16(19-3)17(12-14)20-5-2/h9-10,12,15H,4-8,11,13H2,1-3H3/p+1/t15-/m0/s1