8-bromanyl-3-butyl-1-[[4-(2-methylphenyl)phenyl]methyl]quinolin-4-one

Systemtic Name: 8-bromanyl-3-butyl-1-[[4-(2-methylphenyl)phenyl]methyl]quinolin-4-one Openeye Name: 8-bromo-3-butyl-1-[[4-(o-tolyl)phenyl]methyl]quinolin-4-one CAS Name: 8-bromo-3-butyl-1-[[4-(2-methylphenyl)phenyl]methyl]-4-quinolinone IUPAC Name: 8-bromo-3-butyl-1-[[4-(2-methylphenyl)phenyl]methyl]quinolin-4-one Traditional Name: 8-bromo-3-butyl-1-[4-(o-tolyl)benzyl]-4-quinolone Formula: C27H26BrNO MolecularWeight: 460.40544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C2=C(C1=O)C=CC=C2Br)CC3=CC=C(C=C3)C4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CN(C2=C(C1=O)C=CC=C2Br)CC3=CC=C(C=C3)C4=CC=CC=C4C

InChI

InChI=1S/C27H26BrNO/c1-3-4-9-22-18-29(26-24(27(22)30)11-7-12-25(26)28)17-20-13-15-21(16-14-20)23-10-6-5-8-19(23)2/h5-8,10-16,18H,3-4,9,17H2,1-2H3