ethyl 1-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]-2-(3-methoxyphenyl)-2-oxidanylidene-ethanesulfonate

Systemtic Name: ethyl 1-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]-2-(3-methoxyphenyl)-2-oxidanylidene-ethanesulfonate Openeye Name: ethyl 1-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]-2-(3-methoxyphenyl)-2-oxo-ethanesulfonate CAS Name: 1-[3-(3,4-dichlorophenyl)-3-pyrrolidinyl]-2-(3-methoxyphenyl)-2-oxoethanesulfonic acid ethyl ester IUPAC Name: ethyl 1-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]-2-(3-methoxyphenyl)-2-oxoethanesulfonate Traditional Name: 1-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]-2-keto-2-(3-methoxyphenyl)ethanesulfonic acid ethyl ester Formula: C21H23Cl2NO5S MolecularWeight: 472.38202

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C(C(=O)C1=CC(=CC=C1)OC)C2(CCNC2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOS(=O)(=O)C(C(=O)C1=CC(=CC=C1)OC)C2(CCNC2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2NO5S/c1-3-29-30(26,27)20(19(25)14-5-4-6-16(11-14)28-2)21(9-10-24-13-21)15-7-8-17(22)18(23)12-15/h4-8,11-12,20,24H,3,9-10,13H2,1-2H3