[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-(2-methylsulfonylphenyl)methanone

Systemtic Name: [2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-(2-methylsulfonylphenyl)methanone Openeye Name: [2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-(2-methylsulfonylphenyl)methanone CAS Name: [2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-(2-methylsulfonylphenyl)methanone IUPAC Name: [2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]-(2-methylsulfonylphenyl)methanone Traditional Name: [2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-(2-mesylphenyl)methanone Formula: C20H21ClN2O6S MolecularWeight: 452.90854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C20H21ClN2O6S/c1-28-15-10-9-14(21)18(29-2)17(15)20(25)23-12-6-11-22(23)19(24)13-7-4-5-8-16(13)30(3,26)27/h4-5,7-10H,6,11-12H2,1-3H3