1-[4-[[4,5-bis(bromanyl)-2-butyl-imidazol-1-yl]methyl]phenyl]pyrrole-2-carboxylic acid

Systemtic Name: 1-[4-[[4,5-bis(bromanyl)-2-butyl-imidazol-1-yl]methyl]phenyl]pyrrole-2-carboxylic acid Openeye Name: 1-[4-[(4,5-dibromo-2-butyl-imidazol-1-yl)methyl]phenyl]pyrrole-2-carboxylic acid CAS Name: 1-[4-[(4,5-dibromo-2-butyl-1-imidazolyl)methyl]phenyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-[4-[(4,5-dibromo-2-butylimidazol-1-yl)methyl]phenyl]pyrrole-2-carboxylic acid Traditional Name: 1-[4-[(4,5-dibromo-2-butyl-imidazol-1-yl)methyl]phenyl]pyrrole-2-carboxylic acid Formula: C19H19Br2N3O2 MolecularWeight: 481.18106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)N3C=CC=C3C(=O)O)Br)Br

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)N3C=CC=C3C(=O)O)Br)Br

InChI

InChI=1S/C19H19Br2N3O2/c1-2-3-6-16-22-17(20)18(21)24(16)12-13-7-9-14(10-8-13)23-11-4-5-15(23)19(25)26/h4-5,7-11H,2-3,6,12H2,1H3,(H,25,26)