(4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]methanone

Systemtic Name: (4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]methanone Openeye Name: (4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]methanone CAS Name: (4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methyl-3-pyrrolidin-1-iumyl]methanone IUPAC Name: (4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methylpyrrolidin-1-ium-3-yl]methanone Traditional Name: (4-chlorophenyl)-[(3R,4S)-4-(4-dimethylaminophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]methanone Formula: C20H24ClN2O+ MolecularWeight: 343.87036

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(C(C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[NH+]1C[C@@H]([C@H](C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H23ClN2O/c1-22(2)17-10-6-14(7-11-17)18-12-23(3)13-19(18)20(24)15-4-8-16(21)9-5-15/h4-11,18-19H,12-13H2,1-3H3/p+1/t18-,19+/m1/s1