2-[2-[azanyl(ethoxy)phosphinothioyl]oxybutan-2-yl]-4-methyl-1-nitro-benzene

Systemtic Name: 2-[2-[azanyl(ethoxy)phosphinothioyl]oxybutan-2-yl]-4-methyl-1-nitro-benzene Openeye Name: 2-[1-[amino(ethoxy)phosphinothioyl]oxy-1-methyl-propyl]-4-methyl-1-nitro-benzene CAS Name: 2-[2-[amino(ethoxy)phosphinothioyl]oxybutan-2-yl]-4-methyl-1-nitrobenzene IUPAC Name: 2-[2-[amino(ethoxy)phosphinothioyl]oxybutan-2-yl]-4-methyl-1-nitrobenzene Traditional Name: [ethoxy-[1-methyl-1-(5-methyl-2-nitro-phenyl)propoxy]thiophosphoryl]amine Formula: C13H21N2O4PS MolecularWeight: 332.355601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=C(C=CC(=C1)C)[N+](=O)[O-])OP(=S)(N)OCC

Isomeric SMILES

CCC(C)(C1=C(C=CC(=C1)C)[N+](=O)[O-])OP(=S)(N)OCC

InChI

InChI=1S/C13H21N2O4PS/c1-5-13(4,19-20(14,21)18-6-2)11-9-10(3)7-8-12(11)15(16)17/h7-9H,5-6H2,1-4H3,(H2,14,21)