6-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carbonyl chloride

Systemtic Name: 6-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carbonyl chloride Openeye Name: 2-(3-isobutoxyphenyl)-6-methyl-quinoline-4-carbonyl chloride CAS Name: 6-methyl-2-[3-(2-methylpropoxy)phenyl]-4-quinolinecarbonyl chloride IUPAC Name: 6-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carbonyl chloride Traditional Name: 2-(3-isobutoxyphenyl)-6-methyl-quinoline-4-carbonyl chloride Formula: C21H20ClNO2 MolecularWeight: 353.842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)Cl)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)Cl)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C21H20ClNO2/c1-13(2)12-25-16-6-4-5-15(10-16)20-11-18(21(22)24)17-9-14(3)7-8-19(17)23-20/h4-11,13H,12H2,1-3H3