4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(2-carboxyethyl)-2-methyl-1H-pyrrol-3-yl]-4-keto-butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1)CCC(=O)O)C(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=CN1)CCC(=O)O)C(=O)CCC(=O)O

InChI

InChI=1S/C12H15NO5/c1-7-12(9(14)3-5-11(17)18)8(6-13-7)2-4-10(15)16/h6,13H,2-5H2,1H3,(H,15,16)(H,17,18)