2-[3-[3-(dimethoxymethyl)-4-nitro-phenoxy]propylsulfinyl]-1-(2-methylphenyl)imidazole

Systemtic Name: 2-[3-[3-(dimethoxymethyl)-4-nitro-phenoxy]propylsulfinyl]-1-(2-methylphenyl)imidazole Openeye Name: 2-[3-[3-(dimethoxymethyl)-4-nitro-phenoxy]propylsulfinyl]-1-(o-tolyl)imidazole CAS Name: 2-[3-[3-(dimethoxymethyl)-4-nitrophenoxy]propylsulfinyl]-1-(2-methylphenyl)imidazole IUPAC Name: 2-[3-[3-(dimethoxymethyl)-4-nitrophenoxy]propylsulfinyl]-1-(2-methylphenyl)imidazole Traditional Name: 2-[3-[3-(dimethoxymethyl)-4-nitro-phenoxy]propylsulfinyl]-1-(o-tolyl)imidazole Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2S(=O)CCCOC3=CC(=C(C=C3)[N+](=O)[O-])C(OC)OC

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2S(=O)CCCOC3=CC(=C(C=C3)[N+](=O)[O-])C(OC)OC

InChI

InChI=1S/C22H25N3O6S/c1-16-7-4-5-8-19(16)24-12-11-23-22(24)32(28)14-6-13-31-17-9-10-20(25(26)27)18(15-17)21(29-2)30-3/h4-5,7-12,15,21H,6,13-14H2,1-3H3