methylsulfanylmethyl 11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoate

Systemtic Name: methylsulfanylmethyl 11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoate Openeye Name: methylsulfanylmethyl 11-(1,3-dioxoisoindolin-2-yl)undecanoate CAS Name: 11-(1,3-dioxo-2-isoindolyl)undecanoic acid (methylthio)methyl ester IUPAC Name: methylsulfanylmethyl 11-(1,3-dioxoisoindol-2-yl)undecanoate Traditional Name: 11-phthalimidoundecanoic acid (methylthio)methyl ester Formula: C21H29NO4S MolecularWeight: 391.52426

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Descriptors Computed from Structure

Canonical SMILES:

CSCOC(=O)CCCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CSCOC(=O)CCCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C21H29NO4S/c1-27-16-26-19(23)14-8-6-4-2-3-5-7-11-15-22-20(24)17-12-9-10-13-18(17)21(22)25/h9-10,12-13H,2-8,11,14-16H2,1H3