[2,6-dimethoxy-4-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]carbonyl-phenyl] ethanoate

Systemtic Name: [2,6-dimethoxy-4-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]carbonyl-phenyl] ethanoate Openeye Name: [2,6-dimethoxy-4-[2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbonyl]phenyl] acetate CAS Name: acetic acid [2,6-dimethoxy-4-[[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-[2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbonyl]phenyl] acetate Traditional Name: acetic acid [4-[2-(2-mesylbenzoyl)pyrazolidine-1-carbonyl]-2,6-dimethoxy-phenyl] ester Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C)OC

InChI

InChI=1S/C22H24N2O8S/c1-14(25)32-20-17(30-2)12-15(13-18(20)31-3)21(26)23-10-7-11-24(23)22(27)16-8-5-6-9-19(16)33(4,28)29/h5-6,8-9,12-13H,7,10-11H2,1-4H3