3-bromanyl-1-[4-[(2-butyl-4-methanoyl-imidazol-1-yl)methyl]phenyl]indole-7-carboxylic acid

Systemtic Name: 3-bromanyl-1-[4-[(2-butyl-4-methanoyl-imidazol-1-yl)methyl]phenyl]indole-7-carboxylic acid Openeye Name: 3-bromo-1-[4-[(2-butyl-4-formyl-imidazol-1-yl)methyl]phenyl]indole-7-carboxylic acid CAS Name: 3-bromo-1-[4-[(2-butyl-4-formyl-1-imidazolyl)methyl]phenyl]-7-indolecarboxylic acid IUPAC Name: 3-bromo-1-[4-[(2-butyl-4-formylimidazol-1-yl)methyl]phenyl]indole-7-carboxylic acid Traditional Name: 3-bromo-1-[4-[(2-butyl-4-formyl-imidazol-1-yl)methyl]phenyl]indole-7-carboxylic acid Formula: C24H22BrN3O3 MolecularWeight: 480.35378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1CC2=CC=C(C=C2)N3C=C(C4=C3C(=CC=C4)C(=O)O)Br)C=O

Isomeric SMILES

CCCCC1=NC(=CN1CC2=CC=C(C=C2)N3C=C(C4=C3C(=CC=C4)C(=O)O)Br)C=O

InChI

InChI=1S/C24H22BrN3O3/c1-2-3-7-22-26-17(15-29)13-27(22)12-16-8-10-18(11-9-16)28-14-21(25)19-5-4-6-20(23(19)28)24(30)31/h4-6,8-11,13-15H,2-3,7,12H2,1H3,(H,30,31)