methyl 4-[4-(7-bromanylquinolin-3-yl)oxyphenoxy]pentanoate

Systemtic Name: methyl 4-[4-(7-bromanylquinolin-3-yl)oxyphenoxy]pentanoate Openeye Name: methyl 4-[4-[(7-bromo-3-quinolyl)oxy]phenoxy]pentanoate CAS Name: 4-[4-[(7-bromo-3-quinolinyl)oxy]phenoxy]pentanoic acid methyl ester IUPAC Name: methyl 4-[4-(7-bromoquinolin-3-yl)oxyphenoxy]pentanoate Traditional Name: 4-[4-[(7-bromo-3-quinolyl)oxy]phenoxy]valeric acid methyl ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OC)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=C2)Br

Isomeric SMILES

CC(CCC(=O)OC)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=C2)Br

InChI

InChI=1S/C21H20BrNO4/c1-14(3-10-21(24)25-2)26-17-6-8-18(9-7-17)27-19-11-15-4-5-16(22)12-20(15)23-13-19/h4-9,11-14H,3,10H2,1-2H3