2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(2-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(2-methyl-N-methylsulfonylanilino)acetic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(2-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-2-methyl-anilino)acetic acid 2-phthalimidoethyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C

InChI

InChI=1S/C20H20N2O6S/c1-14-7-3-6-10-17(14)22(29(2,26)27)13-18(23)28-12-11-21-19(24)15-8-4-5-9-16(15)20(21)25/h3-10H,11-13H2,1-2H3