5-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methoxy-aniline

Systemtic Name: 5-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methoxy-aniline Openeye Name: 5-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methoxy-aniline CAS Name: 5-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-2-methoxyaniline IUPAC Name: 5-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methoxyaniline Traditional Name: [5-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methoxy-phenyl]amine Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O/c1-3-13-6-4-5-9-17(13)11-12-7-8-15(18-2)14(16)10-12/h7-8,10,13H,3-6,9,11,16H2,1-2H3/p+1/t13-/m0/s1