2-[[(4-fluoranyl-2-methyl-phenyl)amino]methyl]-6-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-4-carboxylic acid

Systemtic Name: 2-[[(4-fluoranyl-2-methyl-phenyl)amino]methyl]-6-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Openeye Name: 2-[(4-fluoro-2-methyl-anilino)methyl]-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-4-carboxylic acid CAS Name: 2-[(4-fluoro-2-methylanilino)methyl]-6-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridine-4-carboxylic acid IUPAC Name: 2-[(4-fluoro-2-methylanilino)methyl]-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Traditional Name: 2-[(4-fluoro-2-methyl-anilino)methyl]-6-(4-ketocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Formula: C20H17FN2O3 MolecularWeight: 352.358983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NCC2=CC(=CC(=C3C=CC(=O)C=C3)N2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)F)NCC2=CC(=CC(=C3C=CC(=O)C=C3)N2)C(=O)O

InChI

InChI=1S/C20H17FN2O3/c1-12-8-15(21)4-7-18(12)22-11-16-9-14(20(25)26)10-19(23-16)13-2-5-17(24)6-3-13/h2-10,22-23H,11H2,1H3,(H,25,26)