diethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-ethynyl-propanedioate

Systemtic Name: diethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-ethynyl-propanedioate Openeye Name: diethyl 2-(1,3-dioxoisoindolin-2-yl)-2-ethynyl-propanedioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-2-ethynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,3-dioxoisoindol-2-yl)-2-ethynylpropanedioate Traditional Name: 2-ethynyl-2-phthalimido-malonic acid diethyl ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#C)(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCOC(=O)C(C#C)(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C17H15NO6/c1-4-17(15(21)23-5-2,16(22)24-6-3)18-13(19)11-9-7-8-10-12(11)14(18)20/h1,7-10H,5-6H2,2-3H3