ethane; [ethylamino-(4-methyl-2-nitro-phenoxy)phosphoryl]sulfanylphosphonamidic acid

Systemtic Name: ethane; [ethylamino-(4-methyl-2-nitro-phenoxy)phosphoryl]sulfanylphosphonamidic acid Openeye Name: ethane; [ethylamino-(4-methyl-2-nitro-phenoxy)phosphoryl]sulfanylphosphonamidic acid CAS Name: ethane; [[ethylamino-(4-methyl-2-nitrophenoxy)phosphoryl]thio]phosphonamidic acid IUPAC Name: ethane; [ethylamino-(4-methyl-2-nitrophenoxy)phosphoryl]sulfanylphosphonamidic acid Traditional Name: ethane; [[ethylamino-(4-methyl-2-nitro-phenoxy)phosphoryl]thio]phosphonamidic acid Formula: C11H21N3O6P2S MolecularWeight: 385.313462

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCNP(=O)(OC1=C(C=C(C=C1)C)[N+](=O)[O-])SP(=O)(N)O

Isomeric SMILES

CC.CCNP(=O)(OC1=C(C=C(C=C1)C)[N+](=O)[O-])SP(=O)(N)O

InChI

InChI=1S/C9H15N3O6P2S.C2H6/c1-3-11-20(17,21-19(10,15)16)18-9-5-4-7(2)6-8(9)12(13)14;1-2/h4-6H,3H2,1-2H3,(H,11,17)(H3,10,15,16);1-2H3