6-tert-butyl-2-[3-chloranyl-4-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-1H-benzimidazole

Systemtic Name: 6-tert-butyl-2-[3-chloranyl-4-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-1H-benzimidazole Openeye Name: 6-tert-butyl-2-[3-chloro-4-[3-(1-methyl-4-piperidyl)propoxy]phenyl]-1H-benzimidazole CAS Name: 6-tert-butyl-2-[3-chloro-4-[3-(1-methyl-4-piperidinyl)propoxy]phenyl]-1H-benzimidazole IUPAC Name: 6-tert-butyl-2-[3-chloro-4-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-1H-benzimidazole Traditional Name: 6-tert-butyl-2-[3-chloro-4-[3-(1-methyl-4-piperidyl)propoxy]phenyl]-1H-benzimidazole Formula: C26H34ClN3O MolecularWeight: 440.02066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=C(N2)C3=CC(=C(C=C3)OCCCC4CCN(CC4)C)Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=C(N2)C3=CC(=C(C=C3)OCCCC4CCN(CC4)C)Cl

InChI

InChI=1S/C26H34ClN3O/c1-26(2,3)20-8-9-22-23(17-20)29-25(28-22)19-7-10-24(21(27)16-19)31-15-5-6-18-11-13-30(4)14-12-18/h7-10,16-18H,5-6,11-15H2,1-4H3,(H,28,29)