(E)-2-[(6-chloranylpyridin-3-yl)amino]but-2-enedioic acid

Systemtic Name: (E)-2-[(6-chloranylpyridin-3-yl)amino]but-2-enedioic acid Openeye Name: (E)-2-[(6-chloro-3-pyridyl)amino]but-2-enedioic acid CAS Name: (E)-2-[(6-chloro-3-pyridinyl)amino]-2-butenedioic acid IUPAC Name: (E)-2-[(6-chloropyridin-3-yl)amino]but-2-enedioic acid Traditional Name: (E)-2-[(6-chloro-3-pyridyl)amino]but-2-enedioic acid Formula: C9H7ClN2O4 MolecularWeight: 242.61588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NC(=CC(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=CC(=NC=C1N/C(=C/C(=O)O)/C(=O)O)Cl

InChI

InChI=1S/C9H7ClN2O4/c10-7-2-1-5(4-11-7)12-6(9(15)16)3-8(13)14/h1-4,12H,(H,13,14)(H,15,16)/b6-3+