2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]butanoic acid

Systemtic Name: 2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]butanoic acid Openeye Name: 2-(3-methyl-2,5-dioxo-pyrrol-1-yl)butanoic acid CAS Name: 2-(3-methyl-2,5-dioxo-1-pyrrolyl)butanoic acid IUPAC Name: 2-(3-methyl-2,5-dioxopyrrol-1-yl)butanoic acid Traditional Name: 2-citraconimidobutyric acid Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C(=O)C=C(C1=O)C

Isomeric SMILES

CCC(C(=O)O)N1C(=O)C=C(C1=O)C

InChI

InChI=1S/C9H11NO4/c1-3-6(9(13)14)10-7(11)4-5(2)8(10)12/h4,6H,3H2,1-2H3,(H,13,14)