2-[2-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-keto-ethyl]isoindoline-1,3-quinone Formula: C22H20ClN3O6 MolecularWeight: 457.8637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H20ClN3O6/c1-31-16-9-8-15(23)19(32-2)18(16)22(30)26-11-5-10-25(26)17(27)12-24-20(28)13-6-3-4-7-14(13)21(24)29/h3-4,6-9H,5,10-12H2,1-2H3