(3,4-dimethylphenyl) (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (3,4-dimethylphenyl) (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (3,4-dimethylphenyl) (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-chlorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylic acid (3,4-dimethylphenyl) ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C19H20ClNO4S/c1-13-5-8-16(12-14(13)2)25-19(22)18-4-3-11-21(18)26(23,24)17-9-6-15(20)7-10-17/h5-10,12,18H,3-4,11H2,1-2H3/t18-/m0/s1