[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 2-(3-chloranylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 2-(3-chloranylphenoxy)propanoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 2-(3-chlorophenoxy)propanoate CAS Name: 2-(3-chlorophenoxy)propanoic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 2-(3-chlorophenoxy)propanoate Traditional Name: 2-(3-chlorophenoxy)propionic acid [2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl] ester Formula: C21H22ClNO6S MolecularWeight: 451.92048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)OCC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClNO6S/c1-15(29-18-6-4-5-17(22)13-18)21(25)28-14-20(24)16-7-9-19(10-8-16)30(26,27)23-11-2-3-12-23/h4-10,13,15H,2-3,11-12,14H2,1H3