2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)butanedioic acid

Systemtic Name: 2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)butanedioic acid Openeye Name: 2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)butanedioic acid CAS Name: 2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)butanedioic acid IUPAC Name: 2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)butanedioic acid Traditional Name: 2-(5-carboxy-2,4-dimethyl-1H-pyrrol-3-yl)succinic acid Formula: C11H13NO6 MolecularWeight: 255.22402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(CC(=O)O)C(=O)O)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C(CC(=O)O)C(=O)O)C)C(=O)O

InChI

InChI=1S/C11H13NO6/c1-4-8(5(2)12-9(4)11(17)18)6(10(15)16)3-7(13)14/h6,12H,3H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)