3-[5-(butanoylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: 3-[5-(butanoylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: 3-[5-(butanoylamino)-1,3-dioxo-isoindolin-2-yl]propanoate CAS Name: 3-[1,3-dioxo-5-(1-oxobutylamino)-2-isoindolyl]propanoate IUPAC Name: 3-[5-(butanoylamino)-1,3-dioxoisoindol-2-yl]propanoate Traditional Name: 3-(5-butyramido-1,3-diketo-isoindolin-2-yl)propionate Formula: C15H15N2O5- MolecularWeight: 303.29

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)[O-]

InChI

InChI=1S/C15H16N2O5/c1-2-3-12(18)16-9-4-5-10-11(8-9)15(22)17(14(10)21)7-6-13(19)20/h4-5,8H,2-3,6-7H2,1H3,(H,16,18)(H,19,20)/p-1