3-[[5-bromanyl-1-[(4-bromophenyl)methyl]-2-methyl-indol-3-yl]methyl]pentanoic acid

Systemtic Name: 3-[[5-bromanyl-1-[(4-bromophenyl)methyl]-2-methyl-indol-3-yl]methyl]pentanoic acid Openeye Name: 3-[[5-bromo-1-[(4-bromophenyl)methyl]-2-methyl-indol-3-yl]methyl]pentanoic acid CAS Name: 3-[[5-bromo-1-[(4-bromophenyl)methyl]-2-methyl-3-indolyl]methyl]pentanoic acid IUPAC Name: 3-[[5-bromo-1-[(4-bromophenyl)methyl]-2-methylindol-3-yl]methyl]pentanoic acid Traditional Name: 3-[[5-bromo-1-(4-bromobenzyl)-2-methyl-indol-3-yl]methyl]valeric acid Formula: C22H23Br2NO2 MolecularWeight: 493.23152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=C(N(C2=C1C=C(C=C2)Br)CC3=CC=C(C=C3)Br)C)CC(=O)O

Isomeric SMILES

CCC(CC1=C(N(C2=C1C=C(C=C2)Br)CC3=CC=C(C=C3)Br)C)CC(=O)O

InChI

InChI=1S/C22H23Br2NO2/c1-3-15(11-22(26)27)10-19-14(2)25(13-16-4-6-17(23)7-5-16)21-9-8-18(24)12-20(19)21/h4-9,12,15H,3,10-11,13H2,1-2H3,(H,26,27)