(3,4-dichlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (3,4-dichlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: (3,4-dichlorophenyl) 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid (3,4-dichlorophenyl) ester IUPAC Name: (3,4-dichlorophenyl) 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-phthalimido-butyric acid (3,4-dichlorophenyl) ester Formula: C19H15Cl2NO4S MolecularWeight: 424.2977

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OC1=CC(=C(C=C1)Cl)Cl)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CSCCC(C(=O)OC1=CC(=C(C=C1)Cl)Cl)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H15Cl2NO4S/c1-27-9-8-16(19(25)26-11-6-7-14(20)15(21)10-11)22-17(23)12-4-2-3-5-13(12)18(22)24/h2-7,10,16H,8-9H2,1H3