1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-(phenylazanylmethyl)quinoline-3-carboxylic acid chloride

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-(phenylazanylmethyl)quinoline-3-carboxylic acid chloride Openeye Name: 7-(anilinomethyl)-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid chloride CAS Name: 7-(anilinomethyl)-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid chloride IUPAC Name: 7-(anilinomethyl)-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid chloride Traditional Name: 7-(anilinomethyl)-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid chloride Formula: C20H16ClF2N2O3- MolecularWeight: 405.802446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)CNC4=CC=CC=C4)F)C(=O)O.[Cl-]

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)CNC4=CC=CC=C4)F)C(=O)O.[Cl-]

InChI

InChI=1S/C20H16F2N2O3.ClH/c21-16-8-13-18(17(22)14(16)9-23-11-4-2-1-3-5-11)24(12-6-7-12)10-15(19(13)25)20(26)27;/h1-5,8,10,12,23H,6-7,9H2,(H,26,27);1H/p-1