3-[4-[5-chloranyl-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluoranyl-phenoxy]propyl nitrate

Systemtic Name: 3-[4-[5-chloranyl-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluoranyl-phenoxy]propyl nitrate Openeye Name: 3-[4-[5-chloro-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]propyl nitrate CAS Name: nitric acid 3-[4-[5-chloro-3-(4-methylsulfonylphenyl)-4-imidazolyl]-2-fluorophenoxy]propyl ester IUPAC Name: 3-[4-[5-chloro-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluorophenoxy]propyl nitrate Traditional Name: nitric acid 3-[4-[5-chloro-3-(4-mesylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]propyl ester Formula: C19H17ClFN3O6S MolecularWeight: 469.871183

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C=NC(=C2C3=CC(=C(C=C3)OCCCO[N+](=O)[O-])F)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C=NC(=C2C3=CC(=C(C=C3)OCCCO[N+](=O)[O-])F)Cl

InChI

InChI=1S/C19H17ClFN3O6S/c1-31(27,28)15-6-4-14(5-7-15)23-12-22-19(20)18(23)13-3-8-17(16(21)11-13)29-9-2-10-30-24(25)26/h3-8,11-12H,2,9-10H2,1H3