3-[[3,4-bis(fluoranyl)phenyl]carbamoyl]-1-hexyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]carbamoyl]-1-hexyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(3,4-difluorophenyl)carbamoyl]-1-hexyl-4-oxo-quinolin-2-olate CAS Name: 3-[(3,4-difluoroanilino)-oxomethyl]-1-hexyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(3,4-difluorophenyl)carbamoyl]-1-hexyl-4-oxoquinolin-2-olate Traditional Name: 3-[(3,4-difluorophenyl)carbamoyl]-1-hexyl-4-keto-quinolin-2-olate Formula: C22H21F2N2O3- MolecularWeight: 399.410546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C22H22F2N2O3/c1-2-3-4-7-12-26-18-9-6-5-8-15(18)20(27)19(22(26)29)21(28)25-14-10-11-16(23)17(24)13-14/h5-6,8-11,13,29H,2-4,7,12H2,1H3,(H,25,28)/p-1