2-[5-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indol-1-yl]benzoic acid

Systemtic Name: 2-[5-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indol-1-yl]benzoic acid Openeye Name: 2-[5-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indol-1-yl]benzoic acid CAS Name: 2-[5-[[2-butyl-5-(hydroxymethyl)-1-imidazolyl]methyl]-1-indolyl]benzoic acid IUPAC Name: 2-[5-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]indol-1-yl]benzoic acid Traditional Name: 2-[5-[(2-butyl-5-methylol-imidazol-1-yl)methyl]indol-1-yl]benzoic acid Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC3=C(C=C2)N(C=C3)C4=CC=CC=C4C(=O)O)CO

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC3=C(C=C2)N(C=C3)C4=CC=CC=C4C(=O)O)CO

InChI

InChI=1S/C24H25N3O3/c1-2-3-8-23-25-14-19(16-28)27(23)15-17-9-10-21-18(13-17)11-12-26(21)22-7-5-4-6-20(22)24(29)30/h4-7,9-14,28H,2-3,8,15-16H2,1H3,(H,29,30)