(1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Openeye Name: (1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol CAS Name: (1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-(1-pyrrolidin-1-iumyl)-1-propanol IUPAC Name: (1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-pyrrolidin-1-ium-1-ylpropan-1-ol Traditional Name: (1R,2S)-1-(4-chlorophenyl)-1-cyclohexyl-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Formula: C25H33ClNO+ MolecularWeight: 398.98862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=C(C=C2)Cl)(C(C[NH+]3CCCC3)C4=CC=CC=C4)O

Isomeric SMILES

C1CCC(CC1)[C@](C2=CC=C(C=C2)Cl)([C@H](C[NH+]3CCCC3)C4=CC=CC=C4)O

InChI

InChI=1S/C25H32ClNO/c26-23-15-13-22(14-16-23)25(28,21-11-5-2-6-12-21)24(19-27-17-7-8-18-27)20-9-3-1-4-10-20/h1,3-4,9-10,13-16,21,24,28H,2,5-8,11-12,17-19H2/p+1/t24-,25+/m1/s1