4-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)imidazole

Systemtic Name: 4-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)imidazole Openeye Name: 1-(4-nitrophenyl)-4-(p-tolylsulfonyl)imidazole CAS Name: 4-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)imidazole IUPAC Name: 4-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)imidazole Traditional Name: 1-(4-nitrophenyl)-4-tosyl-imidazole Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c1-12-2-8-15(9-3-12)24(22,23)16-10-18(11-17-16)13-4-6-14(7-5-13)19(20)21/h2-11H,1H3