(6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)piperidin-1-ium-4-one

Systemtic Name: (6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)piperidin-1-ium-4-one Openeye Name: (6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)piperidin-1-ium-4-one CAS Name: (6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)-4-piperidin-1-iumone IUPAC Name: (6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)piperidin-1-ium-4-one Traditional Name: (6S)-2,2-dimethyl-6-(3,4,5-trimethoxyphenyl)piperidin-1-ium-4-one Formula: C16H24NO4+ MolecularWeight: 294.36606

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC([NH2+]1)C2=CC(=C(C(=C2)OC)OC)OC)C

Isomeric SMILES

CC1(CC(=O)C[C@H]([NH2+]1)C2=CC(=C(C(=C2)OC)OC)OC)C

InChI

InChI=1S/C16H23NO4/c1-16(2)9-11(18)8-12(17-16)10-6-13(19-3)15(21-5)14(7-10)20-4/h6-7,12,17H,8-9H2,1-5H3/p+1/t12-/m0/s1