1-(4-ethoxyphenyl)sulfonyl-4-nitro-2,6-bis(trifluoromethyl)benzimidazole

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-4-nitro-2,6-bis(trifluoromethyl)benzimidazole Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-4-nitro-2,6-bis(trifluoromethyl)benzimidazole CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-nitro-2,6-bis(trifluoromethyl)benzimidazole IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-4-nitro-2,6-bis(trifluoromethyl)benzimidazole Traditional Name: 4-nitro-1-p-phenetylsulfonyl-2,6-bis(trifluoromethyl)benzimidazole Formula: C17H11F6N3O5S MolecularWeight: 483.341759

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC(=C3)C(F)(F)F)[N+](=O)[O-])N=C2C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC(=C3)C(F)(F)F)[N+](=O)[O-])N=C2C(F)(F)F

InChI

InChI=1S/C17H11F6N3O5S/c1-2-31-10-3-5-11(6-4-10)32(29,30)25-12-7-9(16(18,19)20)8-13(26(27)28)14(12)24-15(25)17(21,22)23/h3-8H,2H2,1H3