4-[(1R)-1-(4-fluorophenyl)-2-nitro-ethyl]sulfanylaniline

Systemtic Name: 4-[(1R)-1-(4-fluorophenyl)-2-nitro-ethyl]sulfanylaniline Openeye Name: 4-[(1R)-1-(4-fluorophenyl)-2-nitro-ethyl]sulfanylaniline CAS Name: 4-[[(1R)-1-(4-fluorophenyl)-2-nitroethyl]thio]aniline IUPAC Name: 4-[(1R)-1-(4-fluorophenyl)-2-nitroethyl]sulfanylaniline Traditional Name: [4-[[(1R)-1-(4-fluorophenyl)-2-nitro-ethyl]thio]phenyl]amine Formula: C14H13FN2O2S MolecularWeight: 292.328623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C[N+](=O)[O-])SC2=CC=C(C=C2)N)F

Isomeric SMILES

C1=CC(=CC=C1[C@H](C[N+](=O)[O-])SC2=CC=C(C=C2)N)F

InChI

InChI=1S/C14H13FN2O2S/c15-11-3-1-10(2-4-11)14(9-17(18)19)20-13-7-5-12(16)6-8-13/h1-8,14H,9,16H2/t14-/m0/s1