bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate

Systemtic Name: bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate Openeye Name: bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate CAS Name: bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate IUPAC Name: bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate Traditional Name: bis[2-(4-nitrophenyl)ethyl] hydrogen phosphate Formula: C16H17N2O8P MolecularWeight: 396.288541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCOP(=O)(O)OCCC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCOP(=O)(O)OCCC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H17N2O8P/c19-17(20)15-5-1-13(2-6-15)9-11-25-27(23,24)26-12-10-14-3-7-16(8-4-14)18(21)22/h1-8H,9-12H2,(H,23,24)