4-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]butanoic acid

Systemtic Name: 4-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]butanoic acid Openeye Name: 4-[3-[(1-isopentylbenzimidazol-2-yl)methyl]-2-oxo-benzimidazol-1-yl]butanoic acid CAS Name: 4-[3-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-2-oxo-1-benzimidazolyl]butanoic acid IUPAC Name: 4-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxobenzimidazol-1-yl]butanoic acid Traditional Name: 4-[3-[(1-isoamylbenzimidazol-2-yl)methyl]-2-keto-benzimidazol-1-yl]butyric acid Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CCCC(=O)O

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CCCC(=O)O

InChI

InChI=1S/C24H28N4O3/c1-17(2)13-15-26-19-9-4-3-8-18(19)25-22(26)16-28-21-11-6-5-10-20(21)27(24(28)31)14-7-12-23(29)30/h3-6,8-11,17H,7,12-16H2,1-2H3,(H,29,30)