2,5-bis(chloranyl)-3-[[(Z)-2-ethoxycarbonyl-3-oxidanylidene-but-1-enyl]amino]benzoic acid

Systemtic Name: 2,5-bis(chloranyl)-3-[[(Z)-2-ethoxycarbonyl-3-oxidanylidene-but-1-enyl]amino]benzoic acid Openeye Name: 2,5-dichloro-3-[[(Z)-2-ethoxycarbonyl-3-oxo-but-1-enyl]amino]benzoic acid CAS Name: 2,5-dichloro-3-[[(Z)-2-ethoxycarbonyl-3-oxobut-1-enyl]amino]benzoic acid IUPAC Name: 2,5-dichloro-3-[[(Z)-2-ethoxycarbonyl-3-oxobut-1-enyl]amino]benzoic acid Traditional Name: 3-[[(Z)-2-carbethoxy-3-keto-but-1-enyl]amino]-2,5-dichloro-benzoic acid Formula: C14H13Cl2NO5 MolecularWeight: 346.16272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C(=CC(=C1)Cl)C(=O)O)Cl)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C\NC1=C(C(=CC(=C1)Cl)C(=O)O)Cl)/C(=O)C

InChI

InChI=1S/C14H13Cl2NO5/c1-3-22-14(21)10(7(2)18)6-17-11-5-8(15)4-9(12(11)16)13(19)20/h4-6,17H,3H2,1-2H3,(H,19,20)/b10-6-