(3E)-4-acetamido-1,2-bis(chloranyl)-3-(2-oxidanylidene-2-phenylazanyl-ethylidene)-4H-quinoline-2-carboxylic acid

Systemtic Name: (3E)-4-acetamido-1,2-bis(chloranyl)-3-(2-oxidanylidene-2-phenylazanyl-ethylidene)-4H-quinoline-2-carboxylic acid Openeye Name: (3E)-4-acetamido-3-(2-anilino-2-oxo-ethylidene)-1,2-dichloro-4H-quinoline-2-carboxylic acid CAS Name: (3E)-4-acetamido-3-(2-anilino-2-oxoethylidene)-1,2-dichloro-4H-quinoline-2-carboxylic acid IUPAC Name: (3E)-4-acetamido-3-(2-anilino-2-oxoethylidene)-1,2-dichloro-4H-quinoline-2-carboxylic acid Traditional Name: (3E)-4-acetamido-3-(2-anilino-2-keto-ethylidene)-1,2-dichloro-4H-quinoline-2-carboxylic acid Formula: C20H17Cl2N3O4 MolecularWeight: 434.27268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2=CC=CC=C2N(C(C1=CC(=O)NC3=CC=CC=C3)(C(=O)O)Cl)Cl

Isomeric SMILES

CC(=O)NC\1C2=CC=CC=C2N(C(/C1=C/C(=O)NC3=CC=CC=C3)(C(=O)O)Cl)Cl

InChI

InChI=1S/C20H17Cl2N3O4/c1-12(26)23-18-14-9-5-6-10-16(14)25(22)20(21,19(28)29)15(18)11-17(27)24-13-7-3-2-4-8-13/h2-11,18H,1H3,(H,23,26)(H,24,27)(H,28,29)/b15-11+