2-(4-chlorophenyl)-1-[(3,5-dimethylphenyl)methoxy]-6-nitro-benzimidazole

Systemtic Name: 2-(4-chlorophenyl)-1-[(3,5-dimethylphenyl)methoxy]-6-nitro-benzimidazole Openeye Name: 2-(4-chlorophenyl)-1-[(3,5-dimethylphenyl)methoxy]-6-nitro-benzimidazole CAS Name: 2-(4-chlorophenyl)-1-[(3,5-dimethylphenyl)methoxy]-6-nitrobenzimidazole IUPAC Name: 2-(4-chlorophenyl)-1-[(3,5-dimethylphenyl)methoxy]-6-nitrobenzimidazole Traditional Name: 2-(4-chlorophenyl)-1-(3,5-dimethylbenzyl)oxy-6-nitro-benzimidazole Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CON2C3=C(C=CC(=C3)[N+](=O)[O-])N=C2C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)CON2C3=C(C=CC(=C3)[N+](=O)[O-])N=C2C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H18ClN3O3/c1-14-9-15(2)11-16(10-14)13-29-25-21-12-19(26(27)28)7-8-20(21)24-22(25)17-3-5-18(23)6-4-17/h3-12H,13H2,1-2H3