(2S)-2-(4-methoxy-3-methyl-phenyl)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-2-(4-methoxy-3-methyl-phenyl)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Openeye Name: (2S)-2-(4-methoxy-3-methyl-phenyl)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-ol CAS Name: (2S)-2-(4-methoxy-3-methylphenyl)-1-(4-methyl-1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-2-(4-methoxy-3-methylphenyl)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Traditional Name: (2S)-2-(4-methoxy-3-methyl-phenyl)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(C)(C2=CC(=C(C=C2)OC)C)O

Isomeric SMILES

CC1CC[NH+](CC1)C[C@](C)(C2=CC(=C(C=C2)OC)C)O

InChI

InChI=1S/C17H27NO2/c1-13-7-9-18(10-8-13)12-17(3,19)15-5-6-16(20-4)14(2)11-15/h5-6,11,13,19H,7-10,12H2,1-4H3/p+1/t17-/m1/s1