1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone

Systemtic Name: 1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone Openeye Name: 1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-(p-tolylsulfonyl)ethanone CAS Name: 1-[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-2-(4-methylphenyl)sulfonylethanone IUPAC Name: 1-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]-2-(4-methylphenyl)sulfonylethanone Traditional Name: 1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-tosyl-ethanone Formula: C21H23ClN2O6S MolecularWeight: 466.93512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)C3=C(C=CC(=C3OC)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)C3=C(C=CC(=C3OC)Cl)OC

InChI

InChI=1S/C21H23ClN2O6S/c1-14-5-7-15(8-6-14)31(27,28)13-18(25)23-11-4-12-24(23)21(26)19-17(29-2)10-9-16(22)20(19)30-3/h5-10H,4,11-13H2,1-3H3