N-[(4-chloranyl-2-nitro-phenoxy)-ethoxy-phosphinothioyl]butan-2-amine

Systemtic Name: N-[(4-chloranyl-2-nitro-phenoxy)-ethoxy-phosphinothioyl]butan-2-amine Openeye Name: N-[(4-chloro-2-nitro-phenoxy)-ethoxy-phosphinothioyl]butan-2-amine CAS Name: N-[(4-chloro-2-nitrophenoxy)-ethoxyphosphinothioyl]-2-butanamine IUPAC Name: N-[(4-chloro-2-nitrophenoxy)-ethoxyphosphinothioyl]butan-2-amine Traditional Name: [(4-chloro-2-nitro-phenoxy)-ethoxy-thiophosphoryl]-sec-butyl-amine Formula: C12H18ClN2O4PS MolecularWeight: 352.774081

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NP(=S)(OCC)OC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NP(=S)(OCC)OC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H18ClN2O4PS/c1-4-9(3)14-20(21,18-5-2)19-12-7-6-10(13)8-11(12)15(16)17/h6-9H,4-5H2,1-3H3,(H,14,21)