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

Systemtic Name: 7-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 7-[(3-chloro-2-fluoro-phenyl)methyl]-4-oxo-quinolizine-3-carboxylic acid CAS Name: 7-[(3-chloro-2-fluorophenyl)methyl]-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 7-[(3-chloro-2-fluorophenyl)methyl]-4-oxoquinolizine-3-carboxylic acid Traditional Name: 7-(3-chloro-2-fluoro-benzyl)-4-keto-quinolizine-3-carboxylic acid Formula: C17H11ClFNO3 MolecularWeight: 331.725543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClFNO3/c18-14-3-1-2-11(15(14)19)8-10-4-5-12-6-7-13(17(22)23)16(21)20(12)9-10/h1-7,9H,8H2,(H,22,23)