(1S)-2-(4-methylpiperidin-1-ium-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanol

Systemtic Name: (1S)-2-(4-methylpiperidin-1-ium-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanol Openeye Name: (1S)-2-(4-methylpiperidin-1-ium-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanol CAS Name: (1S)-2-(4-methyl-1-piperidin-1-iumyl)-1-(3,4,5-trimethoxyphenyl)ethanol IUPAC Name: (1S)-2-(4-methylpiperidin-1-ium-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanol Traditional Name: (1S)-2-(4-methylpiperidin-1-ium-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanol Formula: C17H28NO4+ MolecularWeight: 310.40852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO4/c1-12-5-7-18(8-6-12)11-14(19)13-9-15(20-2)17(22-4)16(10-13)21-3/h9-10,12,14,19H,5-8,11H2,1-4H3/p+1/t14-/m1/s1