3-[5-(2-methylpropanoylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid

Systemtic Name: 3-[5-(2-methylpropanoylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid Openeye Name: 3-[5-(2-methylpropanoylamino)-1,3-dioxo-isoindolin-2-yl]propanoic acid CAS Name: 3-[5-[(2-methyl-1-oxopropyl)amino]-1,3-dioxo-2-isoindolyl]propanoic acid IUPAC Name: 3-[5-(2-methylpropanoylamino)-1,3-dioxoisoindol-2-yl]propanoic acid Traditional Name: 3-[5-(isobutyrylamino)-1,3-diketo-isoindolin-2-yl]propionic acid Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)O

InChI

InChI=1S/C15H16N2O5/c1-8(2)13(20)16-9-3-4-10-11(7-9)15(22)17(14(10)21)6-5-12(18)19/h3-4,7-8H,5-6H2,1-2H3,(H,16,20)(H,18,19)