2-[1-(4-chlorophenyl)-2-nitro-ethyl]sulfanylaniline

Systemtic Name: 2-[1-(4-chlorophenyl)-2-nitro-ethyl]sulfanylaniline Openeye Name: 2-[1-(4-chlorophenyl)-2-nitro-ethyl]sulfanylaniline CAS Name: 2-[[1-(4-chlorophenyl)-2-nitroethyl]thio]aniline IUPAC Name: 2-[1-(4-chlorophenyl)-2-nitroethyl]sulfanylaniline Traditional Name: [2-[[1-(4-chlorophenyl)-2-nitro-ethyl]thio]phenyl]amine Formula: C14H13ClN2O2S MolecularWeight: 308.78322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SC(C[N+](=O)[O-])C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N)SC(C[N+](=O)[O-])C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClN2O2S/c15-11-7-5-10(6-8-11)14(9-17(18)19)20-13-4-2-1-3-12(13)16/h1-8,14H,9,16H2