N-(4-methoxyphenyl)-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: N-(4-methoxyphenyl)-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-(4-methoxyphenyl)-4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-(4-methoxyphenyl)-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-(4-methoxyphenyl)-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-4-mesyl-N-(4-methoxyphenyl)butyramide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H22N2O5S/c1-27-16-9-7-15(8-10-16)21-19(23)18(11-12-28(2,25)26)22-13-14-5-3-4-6-17(14)20(22)24/h3-10,18H,11-13H2,1-2H3,(H,21,23)