(2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol

Systemtic Name: (2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol Openeye Name: (2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol CAS Name: (2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propyl-4-piperidin-1-iumol IUPAC Name: (2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propylpiperidin-1-ium-4-ol Traditional Name: (2R,3S,4S,6R)-2,6-bis(2,5-dimethoxyphenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol Formula: C25H36NO5+ MolecularWeight: 430.55704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC([NH2+]C(C1C)C2=C(C=CC(=C2)OC)OC)C3=C(C=CC(=C3)OC)OC)O

Isomeric SMILES

CCC[C@@]1(C[C@@H]([NH2+][C@H]([C@@H]1C)C2=C(C=CC(=C2)OC)OC)C3=C(C=CC(=C3)OC)OC)O

InChI

InChI=1S/C25H35NO5/c1-7-12-25(27)15-21(19-13-17(28-3)8-10-22(19)30-5)26-24(16(25)2)20-14-18(29-4)9-11-23(20)31-6/h8-11,13-14,16,21,24,26-27H,7,12,15H2,1-6H3/p+1/t16-,21+,24+,25-/m0/s1