methyl 2-[[(2-chloranyl-4-ethyl-5-nitro-phenyl)amino]-methyl-phosphoryl]oxyethanoate

Systemtic Name: methyl 2-[[(2-chloranyl-4-ethyl-5-nitro-phenyl)amino]-methyl-phosphoryl]oxyethanoate Openeye Name: methyl 2-[(2-chloro-4-ethyl-5-nitro-anilino)-methyl-phosphoryl]oxyacetate CAS Name: 2-[(2-chloro-4-ethyl-5-nitroanilino)-methylphosphoryl]oxyacetic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-4-ethyl-5-nitroanilino)-methylphosphoryl]oxyacetate Traditional Name: 2-[(2-chloro-4-ethyl-5-nitro-anilino)-methyl-phosphoryl]oxyacetic acid methyl ester Formula: C12H16ClN2O6P MolecularWeight: 350.692001

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1[N+](=O)[O-])NP(=O)(C)OCC(=O)OC)Cl

Isomeric SMILES

CCC1=CC(=C(C=C1[N+](=O)[O-])NP(=O)(C)OCC(=O)OC)Cl

InChI

InChI=1S/C12H16ClN2O6P/c1-4-8-5-9(13)10(6-11(8)15(17)18)14-22(3,19)21-7-12(16)20-2/h5-6H,4,7H2,1-3H3,(H,14,19)