2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole

Systemtic Name: 2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole Openeye Name: 2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole CAS Name: 2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole IUPAC Name: 2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole Traditional Name: 2-[1-(3,4-dimethylphenoxy)ethyl]-6-nitro-1H-benzimidazole Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(C)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H17N3O3/c1-10-4-6-14(8-11(10)2)23-12(3)17-18-15-7-5-13(20(21)22)9-16(15)19-17/h4-9,12H,1-3H3,(H,18,19)