2-(2-nitro-1-phenyl-ethyl)sulfanylethanamine

Systemtic Name: 2-(2-nitro-1-phenyl-ethyl)sulfanylethanamine Openeye Name: 2-(2-nitro-1-phenyl-ethyl)sulfanylethanamine CAS Name: 2-[(2-nitro-1-phenylethyl)thio]ethanamine IUPAC Name: 2-(2-nitro-1-phenylethyl)sulfanylethanamine Traditional Name: 2-[(2-nitro-1-phenyl-ethyl)thio]ethylamine Formula: C10H14N2O2S MolecularWeight: 226.29536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+](=O)[O-])SCCN

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+](=O)[O-])SCCN

InChI

InChI=1S/C10H14N2O2S/c11-6-7-15-10(8-12(13)14)9-4-2-1-3-5-9/h1-5,10H,6-8,11H2