sodium [C-dimethoxyphosphoryl-N-[(2-methoxy-4-nitro-phenyl)amino]carbonimidoyl]-methoxy-phosphinate

Systemtic Name: sodium [C-dimethoxyphosphoryl-N-[(2-methoxy-4-nitro-phenyl)amino]carbonimidoyl]-methoxy-phosphinate Openeye Name: sodium [C-dimethoxyphosphoryl-N-(2-methoxy-4-nitro-anilino)carbonimidoyl]-methoxy-phosphinate CAS Name: sodium [dimethoxyphosphoryl-[(2-methoxy-4-nitrophenyl)hydrazinylidene]methyl]-methoxyphosphinate IUPAC Name: sodium [C-dimethoxyphosphoryl-N-(2-methoxy-4-nitroanilino)carbonimidoyl]-methoxyphosphinate Traditional Name: sodium [C-dimethoxyphosphoryl-N-(2-methoxy-4-nitro-anilino)carbonimidoyl]-methoxy-phosphinate Formula: C11H16N3NaO9P2 MolecularWeight: 419.196732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NN=C(P(=O)([O-])OC)P(=O)(OC)OC.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NN=C(P(=O)([O-])OC)P(=O)(OC)OC.[Na+]

InChI

InChI=1S/C11H17N3O9P2.Na/c1-20-10-7-8(14(15)16)5-6-9(10)12-13-11(24(17,18)21-2)25(19,22-3)23-4;/h5-7,12H,1-4H3,(H,17,18);/q;+1/p-1