methyl 7-[1,3-bis(oxidanylidene)isoindol-2-yl]hept-5-ynoate

Systemtic Name: methyl 7-[1,3-bis(oxidanylidene)isoindol-2-yl]hept-5-ynoate Openeye Name: methyl 7-(1,3-dioxoisoindolin-2-yl)hept-5-ynoate CAS Name: 7-(1,3-dioxo-2-isoindolyl)-5-heptynoic acid methyl ester IUPAC Name: methyl 7-(1,3-dioxoisoindol-2-yl)hept-5-ynoate Traditional Name: 7-phthalimidohept-5-ynoic acid methyl ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4/c1-21-14(18)10-4-2-3-7-11-17-15(19)12-8-5-6-9-13(12)16(17)20/h5-6,8-9H,2,4,10-11H2,1H3