(2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenyl-piperidin-1-ium-4-ol

Systemtic Name: (2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenyl-piperidin-1-ium-4-ol Openeye Name: (2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenyl-piperidin-1-ium-4-ol CAS Name: (2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenyl-4-piperidin-1-iumol IUPAC Name: (2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenylpiperidin-1-ium-4-ol Traditional Name: (2R,3R,5S,6R)-4-hexyl-3,5-dimethyl-2,6-diphenyl-piperidin-1-ium-4-ol Formula: C25H36NO+ MolecularWeight: 366.55944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(C([NH2+]C(C1C)C2=CC=CC=C2)C3=CC=CC=C3)C)O

Isomeric SMILES

CCCCCCC1([C@@H]([C@@H]([NH2+][C@H]([C@@H]1C)C2=CC=CC=C2)C3=CC=CC=C3)C)O

InChI

InChI=1S/C25H35NO/c1-4-5-6-13-18-25(27)19(2)23(21-14-9-7-10-15-21)26-24(20(25)3)22-16-11-8-12-17-22/h7-12,14-17,19-20,23-24,26-27H,4-6,13,18H2,1-3H3/p+1/t19-,20+,23-,24-,25?/m1/s1