[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-phenylsulfanylpropanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-phenylsulfanylpropanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid phthalimidomethyl ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H15NO4S/c20-16(10-11-24-13-6-2-1-3-7-13)23-12-19-17(21)14-8-4-5-9-15(14)18(19)22/h1-9H,10-12H2