methyl 4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-butyl]sulfanylbenzoate

Systemtic Name: methyl 4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-butyl]sulfanylbenzoate Openeye Name: methyl 4-[4-(1,3-dioxoisoindolin-2-yl)-2-oxo-butyl]sulfanylbenzoate CAS Name: 4-[[4-(1,3-dioxo-2-isoindolyl)-2-oxobutyl]thio]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(1,3-dioxoisoindol-2-yl)-2-oxobutyl]sulfanylbenzoate Traditional Name: 4-[(2-keto-4-phthalimido-butyl)thio]benzoic acid methyl ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)SCC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)SCC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H17NO5S/c1-26-20(25)13-6-8-15(9-7-13)27-12-14(22)10-11-21-18(23)16-4-2-3-5-17(16)19(21)24/h2-9H,10-12H2,1H3