(2S,3R)-2-(4-chloranyl-2-methyl-phenoxy)-4-methyl-3-(4-methylphenyl)-1-pyrrolidin-1-ium-1-yl-pentan-3-ol

Systemtic Name: (2S,3R)-2-(4-chloranyl-2-methyl-phenoxy)-4-methyl-3-(4-methylphenyl)-1-pyrrolidin-1-ium-1-yl-pentan-3-ol Openeye Name: (2S,3R)-2-(4-chloro-2-methyl-phenoxy)-4-methyl-3-(p-tolyl)-1-pyrrolidin-1-ium-1-yl-pentan-3-ol CAS Name: (2S,3R)-2-(4-chloro-2-methylphenoxy)-4-methyl-3-(4-methylphenyl)-1-(1-pyrrolidin-1-iumyl)-3-pentanol IUPAC Name: (2S,3R)-2-(4-chloro-2-methylphenoxy)-4-methyl-3-(4-methylphenyl)-1-pyrrolidin-1-ium-1-ylpentan-3-ol Traditional Name: (2S,3R)-2-(4-chloro-2-methyl-phenoxy)-4-methyl-3-(p-tolyl)-1-pyrrolidin-1-ium-1-yl-pentan-3-ol Formula: C24H33ClNO2+ MolecularWeight: 402.97732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C)C)(C(C[NH+]2CCCC2)OC3=C(C=C(C=C3)Cl)C)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@]([C@H](C[NH+]2CCCC2)OC3=C(C=C(C=C3)Cl)C)(C(C)C)O

InChI

InChI=1S/C24H32ClNO2/c1-17(2)24(27,20-9-7-18(3)8-10-20)23(16-26-13-5-6-14-26)28-22-12-11-21(25)15-19(22)4/h7-12,15,17,23,27H,5-6,13-14,16H2,1-4H3/p+1/t23-,24+/m0/s1