2-(5-bromanyl-1-methyl-indol-3-yl)-4-[(4-ethylphenyl)methoxymethyl]-6-(trifluoromethyl)quinoline

Systemtic Name: 2-(5-bromanyl-1-methyl-indol-3-yl)-4-[(4-ethylphenyl)methoxymethyl]-6-(trifluoromethyl)quinoline Openeye Name: 2-(5-bromo-1-methyl-indol-3-yl)-4-[(4-ethylphenyl)methoxymethyl]-6-(trifluoromethyl)quinoline CAS Name: 2-(5-bromo-1-methyl-3-indolyl)-4-[(4-ethylphenyl)methoxymethyl]-6-(trifluoromethyl)quinoline IUPAC Name: 2-(5-bromo-1-methylindol-3-yl)-4-[(4-ethylphenyl)methoxymethyl]-6-(trifluoromethyl)quinoline Traditional Name: 2-(5-bromo-1-methyl-indol-3-yl)-4-[(4-ethylbenzyl)oxymethyl]-6-(trifluoromethyl)quinoline Formula: C29H24BrF3N2O MolecularWeight: 553.41287

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)COCC2=CC(=NC3=C2C=C(C=C3)C(F)(F)F)C4=CN(C5=C4C=C(C=C5)Br)C

Isomeric SMILES

CCC1=CC=C(C=C1)COCC2=CC(=NC3=C2C=C(C=C3)C(F)(F)F)C4=CN(C5=C4C=C(C=C5)Br)C

InChI

InChI=1S/C29H24BrF3N2O/c1-3-18-4-6-19(7-5-18)16-36-17-20-12-27(25-15-35(2)28-11-9-22(30)14-24(25)28)34-26-10-8-21(13-23(20)26)29(31,32)33/h4-15H,3,16-17H2,1-2H3