4-[[4-[2-(butanoylamino)-3-oxidanyl-3-oxidanylidene-propyl]-2-hexyl-1,2-dihydroimidazol-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-[2-(butanoylamino)-3-oxidanyl-3-oxidanylidene-propyl]-2-hexyl-1,2-dihydroimidazol-3-yl]methyl]benzoic acid Openeye Name: 4-[[4-[2-(butanoylamino)-3-hydroxy-3-oxo-propyl]-2-hexyl-1,2-dihydroimidazol-3-yl]methyl]benzoic acid CAS Name: 4-[[2-hexyl-4-[3-hydroxy-3-oxo-2-(1-oxobutylamino)propyl]-1,2-dihydroimidazol-3-yl]methyl]benzoic acid IUPAC Name: 4-[[4-[2-(butanoylamino)-3-hydroxy-3-oxopropyl]-2-hexyl-1,2-dihydroimidazol-3-yl]methyl]benzoic acid Traditional Name: 4-[[5-(2-butyramido-3-hydroxy-3-keto-propyl)-2-hexyl-4-imidazolin-1-yl]methyl]benzoic acid Formula: C24H35N3O5 MolecularWeight: 445.5518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1NC=C(N1CC2=CC=C(C=C2)C(=O)O)CC(C(=O)O)NC(=O)CCC

Isomeric SMILES

CCCCCCC1NC=C(N1CC2=CC=C(C=C2)C(=O)O)CC(C(=O)O)NC(=O)CCC

InChI

InChI=1S/C24H35N3O5/c1-3-5-6-7-9-21-25-15-19(14-20(24(31)32)26-22(28)8-4-2)27(21)16-17-10-12-18(13-11-17)23(29)30/h10-13,15,20-21,25H,3-9,14,16H2,1-2H3,(H,26,28)(H,29,30)(H,31,32)