2-(2-nitrooxyethyldisulfanyl)ethyl N-[2-(3-fluoranyl-4-phenyl-phenyl)propanoyl]carbamate

Systemtic Name: 2-(2-nitrooxyethyldisulfanyl)ethyl N-[2-(3-fluoranyl-4-phenyl-phenyl)propanoyl]carbamate Openeye Name: 2-(2-nitrooxyethyldisulfanyl)ethyl N-[2-(3-fluoro-4-phenyl-phenyl)propanoyl]carbamate CAS Name: N-[2-(3-fluoro-4-phenylphenyl)-1-oxopropyl]carbamic acid 2-(2-nitrooxyethyldisulfanyl)ethyl ester IUPAC Name: 2-(2-nitrooxyethyldisulfanyl)ethyl N-[2-(3-fluoro-4-phenylphenyl)propanoyl]carbamate Traditional Name: N-[2-(3-fluoro-4-phenyl-phenyl)propanoyl]carbamic acid 2-(2-nitrooxyethyldisulfanyl)ethyl ester Formula: C20H21FN2O6S2 MolecularWeight: 468.518943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)NC(=O)OCCSSCCO[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)NC(=O)OCCSSCCO[N+](=O)[O-]

InChI

InChI=1S/C20H21FN2O6S2/c1-14(16-7-8-17(18(21)13-16)15-5-3-2-4-6-15)19(24)22-20(25)28-9-11-30-31-12-10-29-23(26)27/h2-8,13-14H,9-12H2,1H3,(H,22,24,25)