5-(diethylamino)-2-[(7-fluoranylquinolin-4-yl)amino]pentanoic acid

Systemtic Name: 5-(diethylamino)-2-[(7-fluoranylquinolin-4-yl)amino]pentanoic acid Openeye Name: 5-(diethylamino)-2-[(7-fluoro-4-quinolyl)amino]pentanoic acid CAS Name: 5-(diethylamino)-2-[(7-fluoro-4-quinolinyl)amino]pentanoic acid IUPAC Name: 5-(diethylamino)-2-[(7-fluoroquinolin-4-yl)amino]pentanoic acid Traditional Name: 5-(diethylamino)-2-[(7-fluoro-4-quinolyl)amino]valeric acid Formula: C18H24FN3O2 MolecularWeight: 333.400463

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C(=O)O)NC1=C2C=CC(=CC2=NC=C1)F

Isomeric SMILES

CCN(CC)CCCC(C(=O)O)NC1=C2C=CC(=CC2=NC=C1)F

InChI

InChI=1S/C18H24FN3O2/c1-3-22(4-2)11-5-6-16(18(23)24)21-15-9-10-20-17-12-13(19)7-8-14(15)17/h7-10,12,16H,3-6,11H2,1-2H3,(H,20,21)(H,23,24)