[4-(bromomethyl)-2-nitro-phenyl] dihydrogen phosphate

Systemtic Name: [4-(bromomethyl)-2-nitro-phenyl] dihydrogen phosphate Openeye Name: [4-(bromomethyl)-2-nitro-phenyl] dihydrogen phosphate CAS Name: [4-(bromomethyl)-2-nitrophenyl] dihydrogen phosphate IUPAC Name: [4-(bromomethyl)-2-nitrophenyl] dihydrogen phosphate Traditional Name: [4-(bromomethyl)-2-nitro-phenyl] dihydrogen phosphate Formula: C7H7BrNO6P MolecularWeight: 312.011341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CBr)[N+](=O)[O-])OP(=O)(O)O

Isomeric SMILES

C1=CC(=C(C=C1CBr)[N+](=O)[O-])OP(=O)(O)O

InChI

InChI=1S/C7H7BrNO6P/c8-4-5-1-2-7(15-16(12,13)14)6(3-5)9(10)11/h1-3H,4H2,(H2,12,13,14)