ethyl 2-[3-bromanyl-5-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indazol-2-yl]benzoate

Systemtic Name: ethyl 2-[3-bromanyl-5-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indazol-2-yl]benzoate Openeye Name: ethyl 2-[3-bromo-5-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]indazol-2-yl]benzoate CAS Name: 2-[3-bromo-5-[[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]methyl]-2-indazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[3-bromo-5-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]indazol-2-yl]benzoate Traditional Name: 2-[3-bromo-5-[(2-butyl-4-chloro-5-methylol-imidazol-1-yl)methyl]indazol-2-yl]benzoic acid ethyl ester Formula: C25H26BrClN4O3 MolecularWeight: 545.85594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(N(N=C3C=C2)C4=CC=CC=C4C(=O)OCC)Br)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(N(N=C3C=C2)C4=CC=CC=C4C(=O)OCC)Br)CO)Cl

InChI

InChI=1S/C25H26BrClN4O3/c1-3-5-10-22-28-24(27)21(15-32)30(22)14-16-11-12-19-18(13-16)23(26)31(29-19)20-9-7-6-8-17(20)25(33)34-4-2/h6-9,11-13,32H,3-5,10,14-15H2,1-2H3