3-[3-[(5-chloranyl-1,3-dimethyl-indol-7-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]hexanoic acid

Systemtic Name: 3-[3-[(5-chloranyl-1,3-dimethyl-indol-7-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]hexanoic acid Openeye Name: 3-[3-[(5-chloro-1,3-dimethyl-indol-7-yl)methyl]-2-oxo-benzimidazol-1-yl]hexanoic acid CAS Name: 3-[3-[(5-chloro-1,3-dimethyl-7-indolyl)methyl]-2-oxo-1-benzimidazolyl]hexanoic acid IUPAC Name: 3-[3-[(5-chloro-1,3-dimethylindol-7-yl)methyl]-2-oxobenzimidazol-1-yl]hexanoic acid Traditional Name: 3-[3-[(5-chloro-1,3-dimethyl-indol-7-yl)methyl]-2-keto-benzimidazol-1-yl]hexanoic acid Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=C4C(=CC(=C3)Cl)C(=CN4C)C

Isomeric SMILES

CCCC(CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=C4C(=CC(=C3)Cl)C(=CN4C)C

InChI

InChI=1S/C24H26ClN3O3/c1-4-7-18(12-22(29)30)28-21-9-6-5-8-20(21)27(24(28)31)14-16-10-17(25)11-19-15(2)13-26(3)23(16)19/h5-6,8-11,13,18H,4,7,12,14H2,1-3H3,(H,29,30)