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

Systemtic Name: [(3S,4S)-4-(4-chlorophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone Openeye Name: [(3S,4S)-4-(4-chlorophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone CAS Name: [(3S,4S)-4-(4-chlorophenyl)-1-methyl-3-pyrrolidin-1-iumyl]-(4-methoxyphenyl)methanone IUPAC Name: [(3S,4S)-4-(4-chlorophenyl)-1-methylpyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone Traditional Name: [(3S,4S)-4-(4-chlorophenyl)-1-methyl-pyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone Formula: C19H21ClNO2+ MolecularWeight: 330.82854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClNO2/c1-21-11-17(13-3-7-15(20)8-4-13)18(12-21)19(22)14-5-9-16(23-2)10-6-14/h3-10,17-18H,11-12H2,1-2H3/p+1/t17-,18-/m1/s1