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

Systemtic Name: 2-[4-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]butanedioic acid Openeye Name: 2-(4-methyl-2,5-dioxo-pyrrol-3-yl)butanedioic acid CAS Name: 2-(4-methyl-2,5-dioxo-3-pyrrolyl)butanedioic acid IUPAC Name: 2-(4-methyl-2,5-dioxopyrrol-3-yl)butanedioic acid Traditional Name: 2-(2,5-diketo-4-methyl-3-pyrrolin-3-yl)succinic acid Formula: C9H9NO6 MolecularWeight: 227.17086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC1=O)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=O)NC1=O)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C9H9NO6/c1-3-6(8(14)10-7(3)13)4(9(15)16)2-5(11)12/h4H,2H2,1H3,(H,11,12)(H,15,16)(H,10,13,14)