methyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfonyl]propanoate

Systemtic Name: methyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfonyl]propanoate Openeye Name: methyl 3-[(1,3-dioxoisoindolin-2-yl)methylsulfonyl]propanoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methylsulfonyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(1,3-dioxoisoindol-2-yl)methylsulfonyl]propanoate Traditional Name: 3-(phthalimidomethylsulfonyl)propionic acid methyl ester Formula: C13H13NO6S MolecularWeight: 311.31042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCS(=O)(=O)CN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)CCS(=O)(=O)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H13NO6S/c1-20-11(15)6-7-21(18,19)8-14-12(16)9-4-2-3-5-10(9)13(14)17/h2-5H,6-8H2,1H3