7-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-1-(2-hydroxyethylamino)-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 7-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-1-(2-hydroxyethylamino)-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 7-[(3-chloro-2-fluoro-phenyl)methyl]-1-(2-hydroxyethylamino)-4-oxo-quinolizine-3-carboxylic acid CAS Name: 7-[(3-chloro-2-fluorophenyl)methyl]-1-(2-hydroxyethylamino)-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 7-[(3-chloro-2-fluorophenyl)methyl]-1-(2-hydroxyethylamino)-4-oxoquinolizine-3-carboxylic acid Traditional Name: 7-(3-chloro-2-fluoro-benzyl)-1-(2-hydroxyethylamino)-4-keto-quinolizine-3-carboxylic acid Formula: C19H16ClFN2O4 MolecularWeight: 390.792743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)F)CC2=CN3C(=C(C=C(C3=O)C(=O)O)NCCO)C=C2

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)F)CC2=CN3C(=C(C=C(C3=O)C(=O)O)NCCO)C=C2

InChI

InChI=1S/C19H16ClFN2O4/c20-14-3-1-2-12(17(14)21)8-11-4-5-16-15(22-6-7-24)9-13(19(26)27)18(25)23(16)10-11/h1-5,9-10,22,24H,6-8H2,(H,26,27)