5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride

Systemtic Name: 5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride Openeye Name: 5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride CAS Name: 5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride IUPAC Name: 5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride Traditional Name: 5,6-dimethyl-1-[3-(3-nitrophenoxy)propyl]benzimidazole hydrochloride Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CCCOC3=CC=CC(=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CCCOC3=CC=CC(=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C18H19N3O3.ClH/c1-13-9-17-18(10-14(13)2)20(12-19-17)7-4-8-24-16-6-3-5-15(11-16)21(22)23;/h3,5-6,9-12H,4,7-8H2,1-2H3;1H