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

Systemtic Name: methyl 4-[4-azanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: methyl 4-(4-amino-1,3-dioxo-isoindolin-2-yl)butanoate CAS Name: 4-(4-amino-1,3-dioxo-2-isoindolyl)butanoic acid methyl ester IUPAC Name: methyl 4-(4-amino-1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-(4-amino-1,3-diketo-isoindolin-2-yl)butyric acid methyl ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C(=O)C2=C(C1=O)C(=CC=C2)N

Isomeric SMILES

COC(=O)CCCN1C(=O)C2=C(C1=O)C(=CC=C2)N

InChI

InChI=1S/C13H14N2O4/c1-19-10(16)6-3-7-15-12(17)8-4-2-5-9(14)11(8)13(15)18/h2,4-5H,3,6-7,14H2,1H3