ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxysulfonylbenzoate; 3-methyloxet-2-one

Systemtic Name: ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxysulfonylbenzoate; 3-methyloxet-2-one Openeye Name: ethyl 2-(1,3-dioxoisoindolin-2-yl)oxysulfonylbenzoate; 3-methyloxet-2-one CAS Name: 2-[(1,3-dioxo-2-isoindolyl)oxysulfonyl]benzoic acid ethyl ester; 3-methyl-2-oxetone IUPAC Name: ethyl 2-(1,3-dioxoisoindol-2-yl)oxysulfonylbenzoate; 3-methyloxet-2-one Traditional Name: 3-methyloxet-2-one; 2-phthalimidooxysulfonylbenzoic acid ethyl ester Formula: C21H17NO9S MolecularWeight: 459.42598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1S(=O)(=O)ON2C(=O)C3=CC=CC=C3C2=O.CC1=COC1=O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1S(=O)(=O)ON2C(=O)C3=CC=CC=C3C2=O.CC1=COC1=O

InChI

InChI=1S/C17H13NO7S.C4H4O2/c1-2-24-17(21)13-9-5-6-10-14(13)26(22,23)25-18-15(19)11-7-3-4-8-12(11)16(18)20;1-3-2-6-4(3)5/h3-10H,2H2,1H3;2H,1H3