cyanomethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: cyanomethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: cyanomethyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid cyanomethyl ester Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC#N

InChI

InChI=1S/C14H12N2O4/c15-7-9-20-12(17)6-3-8-16-13(18)10-4-1-2-5-11(10)14(16)19/h1-2,4-5H,3,6,8-9H2