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

Systemtic Name: 2-[4-[5-chloranyl-3-(4-sulfamoylphenyl)imidazol-4-yl]-2-fluoranyl-phenoxy]ethyl nitrate Openeye Name: 2-[4-[5-chloro-3-(4-sulfamoylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]ethyl nitrate CAS Name: nitric acid 2-[4-[5-chloro-3-(4-sulfamoylphenyl)-4-imidazolyl]-2-fluorophenoxy]ethyl ester IUPAC Name: 2-[4-[5-chloro-3-(4-sulfamoylphenyl)imidazol-4-yl]-2-fluorophenoxy]ethyl nitrate Traditional Name: nitric acid 2-[4-[5-chloro-3-(4-sulfamoylphenyl)imidazol-4-yl]-2-fluoro-phenoxy]ethyl ester Formula: C17H14ClFN4O6S MolecularWeight: 456.832663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NC(=C2C3=CC(=C(C=C3)OCCO[N+](=O)[O-])F)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1N2C=NC(=C2C3=CC(=C(C=C3)OCCO[N+](=O)[O-])F)Cl)S(=O)(=O)N

InChI

InChI=1S/C17H14ClFN4O6S/c18-17-16(11-1-6-15(14(19)9-11)28-7-8-29-23(24)25)22(10-21-17)12-2-4-13(5-3-12)30(20,26)27/h1-6,9-10H,7-8H2,(H2,20,26,27)