methyl (E)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-4-sulfanyl-azetidin-1-yl]-3-methoxy-but-2-enoate

Systemtic Name: methyl (E)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-4-sulfanyl-azetidin-1-yl]-3-methoxy-but-2-enoate Openeye Name: methyl (E)-2-[3-(1,3-dioxoisoindolin-2-yl)-2-oxo-4-sulfanyl-azetidin-1-yl]-3-methoxy-but-2-enoate CAS Name: (E)-2-[3-(1,3-dioxo-2-isoindolyl)-2-mercapto-4-oxo-1-azetidinyl]-3-methoxy-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-[3-(1,3-dioxoisoindol-2-yl)-2-oxo-4-sulfanylazetidin-1-yl]-3-methoxybut-2-enoate Traditional Name: (E)-2-(2-keto-4-mercapto-3-phthalimido-azetidin-1-yl)-3-methoxy-but-2-enoic acid methyl ester Formula: C17H16N2O6S MolecularWeight: 376.38374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)N1C(C(C1=O)N2C(=O)C3=CC=CC=C3C2=O)S)OC

Isomeric SMILES

C/C(=C(/C(=O)OC)\N1C(C(C1=O)N2C(=O)C3=CC=CC=C3C2=O)S)/OC

InChI

InChI=1S/C17H16N2O6S/c1-8(24-2)11(17(23)25-3)19-15(22)12(16(19)26)18-13(20)9-6-4-5-7-10(9)14(18)21/h4-7,12,16,26H,1-3H3/b11-8+