2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 3-methyl-2-(tosylamino)butyric acid 2-phthalimidoethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H24N2O6S/c1-14(2)19(23-31(28,29)16-10-8-15(3)9-11-16)22(27)30-13-12-24-20(25)17-6-4-5-7-18(17)21(24)26/h4-11,14,19,23H,12-13H2,1-3H3