(2R,3S)-3-(4-chloranyl-2-methyl-phenoxy)-2-(4-ethoxyphenyl)-1-phenyl-4-pyrrolidin-1-ium-1-yl-butan-2-ol

Systemtic Name: (2R,3S)-3-(4-chloranyl-2-methyl-phenoxy)-2-(4-ethoxyphenyl)-1-phenyl-4-pyrrolidin-1-ium-1-yl-butan-2-ol Openeye Name: (2R,3S)-3-(4-chloro-2-methyl-phenoxy)-2-(4-ethoxyphenyl)-1-phenyl-4-pyrrolidin-1-ium-1-yl-butan-2-ol CAS Name: (2R,3S)-3-(4-chloro-2-methylphenoxy)-2-(4-ethoxyphenyl)-1-phenyl-4-(1-pyrrolidin-1-iumyl)-2-butanol IUPAC Name: (2R,3S)-3-(4-chloro-2-methylphenoxy)-2-(4-ethoxyphenyl)-1-phenyl-4-pyrrolidin-1-ium-1-ylbutan-2-ol Traditional Name: (2R,3S)-3-(4-chloro-2-methyl-phenoxy)-1-phenyl-2-p-phenetyl-4-pyrrolidin-1-ium-1-yl-butan-2-ol Formula: C29H35ClNO3+ MolecularWeight: 481.0461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC2=CC=CC=C2)(C(C[NH+]3CCCC3)OC4=C(C=C(C=C4)Cl)C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@](CC2=CC=CC=C2)([C@H](C[NH+]3CCCC3)OC4=C(C=C(C=C4)Cl)C)O

InChI

InChI=1S/C29H34ClNO3/c1-3-33-26-14-11-24(12-15-26)29(32,20-23-9-5-4-6-10-23)28(21-31-17-7-8-18-31)34-27-16-13-25(30)19-22(27)2/h4-6,9-16,19,28,32H,3,7-8,17-18,20-21H2,1-2H3/p+1/t28-,29+/m0/s1