isocyanato [isocyanatooxy-[isocyanatooxy(oxidanyl)phosphoryl]oxy-phosphoryl] phenyl phosphate

Systemtic Name: isocyanato [isocyanatooxy-[isocyanatooxy(oxidanyl)phosphoryl]oxy-phosphoryl] phenyl phosphate Openeye Name: [hydroxy(isocyanatooxy)phosphoryl] isocyanato [isocyanatooxy(phenoxy)phosphoryl] phosphate CAS Name: phosphoric acid [hydroxy(isocyanatooxy)phosphoryl] isocyanato [isocyanatooxy(phenoxy)phosphoryl] ester IUPAC Name: [hydroxy(isocyanatooxy)phosphoryl] isocyanato [isocyanatooxy(phenoxy)phosphoryl] phosphate Traditional Name: phosphoric acid [hydroxy(isocyanatooxy)phosphoryl] isocyanato [isocyanatooxy(phenoxy)phosphoryl] ester Formula: C9H6N3O13P3 MolecularWeight: 457.077523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(ON=C=O)OP(=O)(ON=C=O)OP(=O)(O)ON=C=O

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(ON=C=O)OP(=O)(ON=C=O)OP(=O)(O)ON=C=O

InChI

InChI=1S/C9H6N3O13P3/c13-6-10-21-26(16,17)24-28(19,23-12-8-15)25-27(18,22-11-7-14)20-9-4-2-1-3-5-9/h1-5H,(H,16,17)