2-[[7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1H-quinolin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1H-quinolin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[7-(cyclohexylamino)-6-fluoro-4-oxo-1H-quinoline-3-carbonyl]amino]acetic acid CAS Name: 2-[[[7-(cyclohexylamino)-6-fluoro-4-oxo-1H-quinolin-3-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[7-(cyclohexylamino)-6-fluoro-4-oxo-1H-quinoline-3-carbonyl]amino]acetic acid Traditional Name: 2-[[7-(cyclohexylamino)-6-fluoro-4-keto-1H-quinoline-3-carbonyl]amino]acetic acid Formula: C18H20FN3O4 MolecularWeight: 361.367503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C=C3C(=C2)NC=C(C3=O)C(=O)NCC(=O)O)F

Isomeric SMILES

C1CCC(CC1)NC2=C(C=C3C(=C2)NC=C(C3=O)C(=O)NCC(=O)O)F

InChI

InChI=1S/C18H20FN3O4/c19-13-6-11-14(7-15(13)22-10-4-2-1-3-5-10)20-8-12(17(11)25)18(26)21-9-16(23)24/h6-8,10,22H,1-5,9H2,(H,20,25)(H,21,26)(H,23,24)