8-[4-(2-bromanyl-4,5-dimethyl-phenoxy)butoxy]quinoline

Systemtic Name: 8-[4-(2-bromanyl-4,5-dimethyl-phenoxy)butoxy]quinoline Openeye Name: 8-[4-(2-bromo-4,5-dimethyl-phenoxy)butoxy]quinoline CAS Name: 8-[4-(2-bromo-4,5-dimethylphenoxy)butoxy]quinoline IUPAC Name: 8-[4-(2-bromo-4,5-dimethylphenoxy)butoxy]quinoline Traditional Name: 8-[4-(2-bromo-4,5-dimethyl-phenoxy)butoxy]quinoline Formula: C21H22BrNO2 MolecularWeight: 400.30888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)Br)OCCCCOC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C)Br)OCCCCOC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C21H22BrNO2/c1-15-13-18(22)20(14-16(15)2)25-12-4-3-11-24-19-9-5-7-17-8-6-10-23-21(17)19/h5-10,13-14H,3-4,11-12H2,1-2H3