[[2-(3,4-dimethylphenoxy)-5-nitro-phenyl]-oxidanyl-methyl]phosphonic acid

Systemtic Name: [[2-(3,4-dimethylphenoxy)-5-nitro-phenyl]-oxidanyl-methyl]phosphonic acid Openeye Name: [[2-(3,4-dimethylphenoxy)-5-nitro-phenyl]-hydroxy-methyl]phosphonic acid CAS Name: [[2-(3,4-dimethylphenoxy)-5-nitrophenyl]-hydroxymethyl]phosphonic acid IUPAC Name: [[2-(3,4-dimethylphenoxy)-5-nitrophenyl]-hydroxymethyl]phosphonic acid Traditional Name: [[2-(3,4-dimethylphenoxy)-5-nitro-phenyl]-hydroxy-methyl]phosphonic acid Formula: C15H16NO7P MolecularWeight: 353.263801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(O)P(=O)(O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(O)P(=O)(O)O)C

InChI

InChI=1S/C15H16NO7P/c1-9-3-5-12(7-10(9)2)23-14-6-4-11(16(18)19)8-13(14)15(17)24(20,21)22/h3-8,15,17H,1-2H3,(H2,20,21,22)