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

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]carbamoyl]-4-oxidanylidene-1-pentyl-quinolin-2-olate Openeye Name: 3-[(3,4-difluorophenyl)carbamoyl]-4-oxo-1-pentyl-quinolin-2-olate CAS Name: 3-[(3,4-difluoroanilino)-oxomethyl]-4-oxo-1-pentyl-2-quinolinolate IUPAC Name: 3-[(3,4-difluorophenyl)carbamoyl]-4-oxo-1-pentylquinolin-2-olate Traditional Name: 1-amyl-3-[(3,4-difluorophenyl)carbamoyl]-4-keto-quinolin-2-olate Formula: C21H19F2N2O3- MolecularWeight: 385.383966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C21H20F2N2O3/c1-2-3-6-11-25-17-8-5-4-7-14(17)19(26)18(21(25)28)20(27)24-13-9-10-15(22)16(23)12-13/h4-5,7-10,12,28H,2-3,6,11H2,1H3,(H,24,27)/p-1