dimethyl 2-chloranyl-2-[2-chloranyl-2-[4-phenyl-1-(phenylsulfonyl)pyrrolidin-3-yl]ethyl]propanedioate

Systemtic Name: dimethyl 2-chloranyl-2-[2-chloranyl-2-[4-phenyl-1-(phenylsulfonyl)pyrrolidin-3-yl]ethyl]propanedioate Openeye Name: dimethyl 2-[2-[1-(benzenesulfonyl)-4-phenyl-pyrrolidin-3-yl]-2-chloro-ethyl]-2-chloro-propanedioate CAS Name: 2-[2-[1-(benzenesulfonyl)-4-phenyl-3-pyrrolidinyl]-2-chloroethyl]-2-chloropropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-[1-(benzenesulfonyl)-4-phenylpyrrolidin-3-yl]-2-chloroethyl]-2-chloropropanedioate Traditional Name: 2-[2-(1-besyl-4-phenyl-pyrrolidin-3-yl)-2-chloro-ethyl]-2-chloro-malonic acid dimethyl ester Formula: C23H25Cl2NO6S MolecularWeight: 514.4187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(C1CN(CC1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)Cl)(C(=O)OC)Cl

Isomeric SMILES

COC(=O)C(CC(C1CN(CC1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)Cl)(C(=O)OC)Cl

InChI

InChI=1S/C23H25Cl2NO6S/c1-31-21(27)23(25,22(28)32-2)13-20(24)19-15-26(14-18(19)16-9-5-3-6-10-16)33(29,30)17-11-7-4-8-12-17/h3-12,18-20H,13-15H2,1-2H3