methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanyl-5-methyl-benzoate

Systemtic Name: methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanyl-5-methyl-benzoate Openeye Name: methyl 2-(1,3-dioxoisoindolin-2-yl)sulfanyl-5-methyl-benzoate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)thio]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-(1,3-dioxoisoindol-2-yl)sulfanyl-5-methylbenzoate Traditional Name: 5-methyl-2-(phthalimidothio)benzoic acid methyl ester Formula: C17H13NO4S MolecularWeight: 327.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)SN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C17H13NO4S/c1-10-7-8-14(13(9-10)17(21)22-2)23-18-15(19)11-5-3-4-6-12(11)16(18)20/h3-9H,1-2H3