1-(4-methylphenyl)sulfonyl-5-nitro-2-propan-2-yl-imidazole

Systemtic Name: 1-(4-methylphenyl)sulfonyl-5-nitro-2-propan-2-yl-imidazole Openeye Name: 2-isopropyl-5-nitro-1-(p-tolylsulfonyl)imidazole CAS Name: 1-(4-methylphenyl)sulfonyl-5-nitro-2-propan-2-ylimidazole IUPAC Name: 1-(4-methylphenyl)sulfonyl-5-nitro-2-propan-2-ylimidazole Traditional Name: 2-isopropyl-5-nitro-1-tosyl-imidazole Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CN=C2C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CN=C2C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c1-9(2)13-14-8-12(16(17)18)15(13)21(19,20)11-6-4-10(3)5-7-11/h4-9H,1-3H3