3-[5-carboxy-1-(carboxymethyl)pyrrol-3-yl]pentanedioic acid

Systemtic Name: 3-[5-carboxy-1-(carboxymethyl)pyrrol-3-yl]pentanedioic acid Openeye Name: 3-[5-carboxy-1-(carboxymethyl)pyrrol-3-yl]pentanedioic acid CAS Name: 3-[5-carboxy-1-(carboxymethyl)-3-pyrrolyl]pentanedioic acid IUPAC Name: 3-[5-carboxy-1-(carboxymethyl)pyrrol-3-yl]pentanedioic acid Traditional Name: 3-[5-carboxy-1-(carboxymethyl)pyrrol-3-yl]glutaric acid Formula: C12H13NO8 MolecularWeight: 299.23352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO8/c14-9(15)2-6(3-10(16)17)7-1-8(12(20)21)13(4-7)5-11(18)19/h1,4,6H,2-3,5H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)