5,6-dimethyl-1-[4-(3-methyl-4-nitro-phenoxy)butyl]benzimidazole hydrochloride

Systemtic Name: 5,6-dimethyl-1-[4-(3-methyl-4-nitro-phenoxy)butyl]benzimidazole hydrochloride Openeye Name: 5,6-dimethyl-1-[4-(3-methyl-4-nitro-phenoxy)butyl]benzimidazole hydrochloride CAS Name: 5,6-dimethyl-1-[4-(3-methyl-4-nitrophenoxy)butyl]benzimidazole hydrochloride IUPAC Name: 5,6-dimethyl-1-[4-(3-methyl-4-nitrophenoxy)butyl]benzimidazole hydrochloride Traditional Name: 5,6-dimethyl-1-[4-(3-methyl-4-nitro-phenoxy)butyl]benzimidazole hydrochloride Formula: C20H24ClN3O3 MolecularWeight: 389.87586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CCCCOC3=CC(=C(C=C3)[N+](=O)[O-])C.Cl

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CCCCOC3=CC(=C(C=C3)[N+](=O)[O-])C.Cl

InChI

InChI=1S/C20H23N3O3.ClH/c1-14-11-18-20(12-15(14)2)22(13-21-18)8-4-5-9-26-17-6-7-19(23(24)25)16(3)10-17;/h6-7,10-13H,4-5,8-9H2,1-3H3;1H