4-[[4-(6-chloranyl-1H-benzimidazol-2-yl)phenyl]amino]-2-(cyclohexylmethyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(6-chloranyl-1H-benzimidazol-2-yl)phenyl]amino]-2-(cyclohexylmethyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(6-chloro-1H-benzimidazol-2-yl)anilino]-2-(cyclohexylmethyl)-4-oxo-butanoic acid CAS Name: 4-[4-(6-chloro-1H-benzimidazol-2-yl)anilino]-2-(cyclohexylmethyl)-4-oxobutanoic acid IUPAC Name: 4-[4-(6-chloro-1H-benzimidazol-2-yl)anilino]-2-(cyclohexylmethyl)-4-oxobutanoic acid Traditional Name: 4-[4-(6-chloro-1H-benzimidazol-2-yl)anilino]-2-(cyclohexylmethyl)-4-keto-butyric acid Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C24H26ClN3O3/c25-18-8-11-20-21(14-18)28-23(27-20)16-6-9-19(10-7-16)26-22(29)13-17(24(30)31)12-15-4-2-1-3-5-15/h6-11,14-15,17H,1-5,12-13H2,(H,26,29)(H,27,28)(H,30,31)