2-[[(6-chloranyl-3-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-8-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(6-chloranyl-3-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-8-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(6-chloro-3-ethoxycarbonyl-4-oxo-1H-quinolin-8-yl)amino]methylene]propanedioic acid CAS Name: 2-[[(6-chloro-3-ethoxycarbonyl-4-oxo-1H-quinolin-8-yl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(6-chloro-3-ethoxycarbonyl-4-oxo-1H-quinolin-8-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(3-carbethoxy-6-chloro-4-keto-1H-quinolin-8-yl)amino]methylene]malonic acid Formula: C16H13ClN2O7 MolecularWeight: 380.73662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)Cl)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)Cl)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C16H13ClN2O7/c1-2-26-16(25)9-5-19-12-8(13(9)20)3-7(17)4-11(12)18-6-10(14(21)22)15(23)24/h3-6,18H,2H2,1H3,(H,19,20)(H,21,22)(H,23,24)