[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid phthalimidomethyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17NO4S/c1-12-7-8-13(2)16(9-12)25-10-17(21)24-11-20-18(22)14-5-3-4-6-15(14)19(20)23/h3-9H,10-11H2,1-2H3