methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]but-2-ynoate

Systemtic Name: methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]but-2-ynoate Openeye Name: methyl 4-(1,3-dioxoisoindolin-2-yl)but-2-ynoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)-2-butynoic acid methyl ester IUPAC Name: methyl 4-(1,3-dioxoisoindol-2-yl)but-2-ynoate Traditional Name: 4-phthalimidobut-2-ynoic acid methyl ester Formula: C13H9NO4 MolecularWeight: 243.21486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)C#CCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H9NO4/c1-18-11(15)7-4-8-14-12(16)9-5-2-3-6-10(9)13(14)17/h2-3,5-6H,8H2,1H3