(E)-2-[(5-carboxy-1-methyl-pyrrol-3-yl)amino]but-2-enedioic acid

Systemtic Name: (E)-2-[(5-carboxy-1-methyl-pyrrol-3-yl)amino]but-2-enedioic acid Openeye Name: (E)-2-[(5-carboxy-1-methyl-pyrrol-3-yl)amino]but-2-enedioic acid CAS Name: (E)-2-[(5-carboxy-1-methyl-3-pyrrolyl)amino]-2-butenedioic acid IUPAC Name: (E)-2-[(5-carboxy-1-methylpyrrol-3-yl)amino]but-2-enedioic acid Traditional Name: (E)-2-[(5-carboxy-1-methyl-pyrrol-3-yl)amino]but-2-enedioic acid Formula: C10H10N2O6 MolecularWeight: 254.1962

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)NC(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1C=C(C=C1C(=O)O)N/C(=C/C(=O)O)/C(=O)O

InChI

InChI=1S/C10H10N2O6/c1-12-4-5(2-7(12)10(17)18)11-6(9(15)16)3-8(13)14/h2-4,11H,1H3,(H,13,14)(H,15,16)(H,17,18)/b6-3+