3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid

Systemtic Name: 3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid Openeye Name: 3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid CAS Name: 3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid IUPAC Name: 3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid Traditional Name: 3,5-bis(carboxymethyl)-1H-pyrrole-2,4-dicarboxylic acid Formula: C10H9NO8 MolecularWeight: 271.18036

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(NC(=C1C(=O)O)CC(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C(C1=C(NC(=C1C(=O)O)CC(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C10H9NO8/c12-5(13)1-3-7(9(16)17)4(2-6(14)15)11-8(3)10(18)19/h11H,1-2H2,(H,12,13)(H,14,15)(H,16,17)(H,18,19)