(3-fluoranyl-4-methoxy-phenyl)methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-(4-butyl-3-oxo-quinoxalin-2-yl)propanoate CAS Name: 3-(4-butyl-3-oxo-2-quinoxalinyl)propanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-(4-butyl-3-oxoquinoxalin-2-yl)propanoate Traditional Name: 3-(4-butyl-3-keto-quinoxalin-2-yl)propionic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C23H25FN2O4/c1-3-4-13-26-20-8-6-5-7-18(20)25-19(23(26)28)10-12-22(27)30-15-16-9-11-21(29-2)17(24)14-16/h5-9,11,14H,3-4,10,12-13,15H2,1-2H3