N-(2-fluoranyl-5-methylsulfonyl-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(2-fluoranyl-5-methylsulfonyl-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(2-fluoro-5-methylsulfonyl-phenyl)-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(2-fluoro-5-methylsulfonylphenyl)-2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(2-fluoro-5-methylsulfonylphenyl)-2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(2-fluoro-5-mesyl-phenyl)-1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxamide Formula: C20H19FN2O6S MolecularWeight: 434.438063

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)F

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)F

InChI

InChI=1S/C20H19FN2O6S/c1-29-9-3-8-23-19(25)14-6-4-12(10-15(14)20(23)26)18(24)22-17-11-13(30(2,27)28)5-7-16(17)21/h4-7,10-11H,3,8-9H2,1-2H3,(H,22,24)