N-(4-ethyl-3-nitro-phenyl)thiolan-3-amine

Systemtic Name: N-(4-ethyl-3-nitro-phenyl)thiolan-3-amine Openeye Name: N-(4-ethyl-3-nitro-phenyl)tetrahydrothiophen-3-amine CAS Name: N-(4-ethyl-3-nitrophenyl)-3-thiolanamine IUPAC Name: N-(4-ethyl-3-nitrophenyl)thiolan-3-amine Traditional Name: (4-ethyl-3-nitro-phenyl)-tetrahydrothiophen-3-yl-amine Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC2CCSC2)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC2CCSC2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O2S/c1-2-9-3-4-10(7-12(9)14(15)16)13-11-5-6-17-8-11/h3-4,7,11,13H,2,5-6,8H2,1H3