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

Systemtic Name: 2-[4-[5-chloranyl-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluoranyl-phenoxy]ethyl nitrate Openeye Name: 2-[4-[5-chloro-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]ethyl nitrate CAS Name: nitric acid 2-[4-[5-chloro-3-(4-methylsulfonylphenyl)-4-imidazolyl]-2-fluorophenoxy]ethyl ester IUPAC Name: 2-[4-[5-chloro-3-(4-methylsulfonylphenyl)imidazol-4-yl]-2-fluorophenoxy]ethyl nitrate Traditional Name: nitric acid 2-[4-[5-chloro-3-(4-mesylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]ethyl ester Formula: C18H15ClFN3O6S MolecularWeight: 455.844603

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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)OCCO[N+](=O)[O-])F)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClFN3O6S/c1-30(26,27)14-5-3-13(4-6-14)22-11-21-18(19)17(22)12-2-7-16(15(20)10-12)28-8-9-29-23(24)25/h2-7,10-11H,8-9H2,1H3