3-[4-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[4-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]propanoic acid Openeye Name: 3-(4-methyl-2,5-dioxo-pyrrol-3-yl)propanoic acid CAS Name: 3-(4-methyl-2,5-dioxo-3-pyrrolyl)propanoic acid IUPAC Name: 3-(4-methyl-2,5-dioxopyrrol-3-yl)propanoic acid Traditional Name: 3-(2,5-diketo-4-methyl-3-pyrrolin-3-yl)propionic acid Formula: C8H9NO4 MolecularWeight: 183.16136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC1=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)NC1=O)CCC(=O)O

InChI

InChI=1S/C8H9NO4/c1-4-5(2-3-6(10)11)8(13)9-7(4)12/h2-3H2,1H3,(H,10,11)(H,9,12,13)