4,4-bis[4-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]pentanoic acid

Systemtic Name: 4,4-bis[4-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]pentanoic acid Openeye Name: 4,4-bis[4-[(7-fluoro-2-quinolyl)methoxy]phenyl]pentanoic acid CAS Name: 4,4-bis[4-[(7-fluoro-2-quinolinyl)methoxy]phenyl]pentanoic acid IUPAC Name: 4,4-bis[4-[(7-fluoroquinolin-2-yl)methoxy]phenyl]pentanoic acid Traditional Name: 4,4-bis[4-[(7-fluoro-2-quinolyl)methoxy]phenyl]valeric acid Formula: C37H30F2N2O4 MolecularWeight: 604.641906

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)(C1=CC=C(C=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2)C4=CC=C(C=C4)OCC5=NC6=C(C=CC(=C6)F)C=C5

Isomeric SMILES

CC(CCC(=O)O)(C1=CC=C(C=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2)C4=CC=C(C=C4)OCC5=NC6=C(C=CC(=C6)F)C=C5

InChI

InChI=1S/C37H30F2N2O4/c1-37(19-18-36(42)43,26-6-14-32(15-7-26)44-22-30-12-4-24-2-10-28(38)20-34(24)40-30)27-8-16-33(17-9-27)45-23-31-13-5-25-3-11-29(39)21-35(25)41-31/h2-17,20-21H,18-19,22-23H2,1H3,(H,42,43)