2-[bis(diphenoxyphosphoryl)methyl-nitroso-amino]ethanoic acid

Systemtic Name: 2-[bis(diphenoxyphosphoryl)methyl-nitroso-amino]ethanoic acid Openeye Name: 2-[bis(diphenoxyphosphoryl)methyl-nitroso-amino]acetic acid CAS Name: 2-[bis(diphenoxyphosphoryl)methyl-nitrosoamino]acetic acid IUPAC Name: 2-[bis(diphenoxyphosphoryl)methyl-nitrosoamino]acetic acid Traditional Name: 2-[bis(diphenoxyphosphoryl)methyl-nitroso-amino]acetic acid Formula: C27H24N2O9P2 MolecularWeight: 582.434982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(C(N(CC(=O)O)N=O)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(C(N(CC(=O)O)N=O)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O9P2/c30-26(31)21-29(28-32)27(39(33,35-22-13-5-1-6-14-22)36-23-15-7-2-8-16-23)40(34,37-24-17-9-3-10-18-24)38-25-19-11-4-12-20-25/h1-20,27H,21H2,(H,30,31)