[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid phthalimidomethyl ester Formula: C17H12ClNO6S MolecularWeight: 393.79828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C17H12ClNO6S/c1-26(23,24)14-8-10(6-7-13(14)18)17(22)25-9-19-15(20)11-4-2-3-5-12(11)16(19)21/h2-8H,9H2,1H3