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

Systemtic Name: 7-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-1-(methoxymethyl)-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 7-[(3-chloro-2-fluoro-phenyl)methyl]-1-(methoxymethyl)-4-oxo-quinolizine-3-carboxylic acid CAS Name: 7-[(3-chloro-2-fluorophenyl)methyl]-1-(methoxymethyl)-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 7-[(3-chloro-2-fluorophenyl)methyl]-1-(methoxymethyl)-4-oxoquinolizine-3-carboxylic acid Traditional Name: 7-(3-chloro-2-fluoro-benzyl)-4-keto-1-(methoxymethyl)quinolizine-3-carboxylic acid Formula: C19H15ClFNO4 MolecularWeight: 375.778103

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C=CC(=CN2C(=O)C(=C1)C(=O)O)CC3=C(C(=CC=C3)Cl)F

Isomeric SMILES

COCC1=C2C=CC(=CN2C(=O)C(=C1)C(=O)O)CC3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C19H15ClFNO4/c1-26-10-13-8-14(19(24)25)18(23)22-9-11(5-6-16(13)22)7-12-3-2-4-15(20)17(12)21/h2-6,8-9H,7,10H2,1H3,(H,24,25)