2-[octoxy-[octoxy(oxidanyl)phosphoryl]oxy-phosphoryl]peroxyethanoic acid

Systemtic Name: 2-[octoxy-[octoxy(oxidanyl)phosphoryl]oxy-phosphoryl]peroxyethanoic acid Openeye Name: 2-[[hydroxy(octoxy)phosphoryl]oxy-octoxy-phosphoryl]peroxyacetic acid CAS Name: 2-[[hydroxy(octoxy)phosphoryl]oxy-octoxyphosphoryl]dioxyacetic acid IUPAC Name: 2-[[hydroxy(octoxy)phosphoryl]oxy-octoxyphosphoryl]peroxyacetic acid Traditional Name: 2-[[hydroxy(octoxy)phosphoryl]oxy-octoxy-phosphoryl]peroxyacetic acid Formula: C18H38O10P2 MolecularWeight: 476.435842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(O)OP(=O)(OCCCCCCCC)OOCC(=O)O

Isomeric SMILES

CCCCCCCCOP(=O)(O)OP(=O)(OCCCCCCCC)OOCC(=O)O

InChI

InChI=1S/C18H38O10P2/c1-3-5-7-9-11-13-15-25-29(21,22)28-30(23,27-24-17-18(19)20)26-16-14-12-10-8-6-4-2/h3-17H2,1-2H3,(H,19,20)(H,21,22)