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

Systemtic Name: undecyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: undecyl 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid undecyl ester IUPAC Name: undecyl 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-phthalimido-butyric acid undecyl ester Formula: C24H35NO4S MolecularWeight: 433.604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C(CCSC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCCCCCCCCOC(=O)C(CCSC)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C24H35NO4S/c1-3-4-5-6-7-8-9-10-13-17-29-24(28)21(16-18-30-2)25-22(26)19-14-11-12-15-20(19)23(25)27/h11-12,14-15,21H,3-10,13,16-18H2,1-2H3