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

Systemtic Name: 2-[[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]methyl]butanoic acid Openeye Name: 2-[[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxo-benzimidazol-1-yl]methyl]butanoic acid CAS Name: 2-[[3-[(1,4-dimethyl-3-indolyl)methyl]-2-oxo-1-benzimidazolyl]methyl]butanoic acid IUPAC Name: 2-[[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxobenzimidazol-1-yl]methyl]butanoic acid Traditional Name: 2-[[3-[(1,4-dimethylindol-3-yl)methyl]-2-keto-benzimidazol-1-yl]methyl]butyric acid Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C)C(=O)O

Isomeric SMILES

CCC(CN1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C)C(=O)O

InChI

InChI=1S/C23H25N3O3/c1-4-16(22(27)28)13-25-18-9-5-6-10-19(18)26(23(25)29)14-17-12-24(3)20-11-7-8-15(2)21(17)20/h5-12,16H,4,13-14H2,1-3H3,(H,27,28)