(1-hexadecanoyloxy-1-phosphono-ethyl)phosphonic acid

Systemtic Name: (1-hexadecanoyloxy-1-phosphono-ethyl)phosphonic acid Openeye Name: (1-hexadecanoyloxy-1-phosphono-ethyl)phosphonic acid CAS Name: [1-(1-oxohexadecoxy)-1-phosphonoethyl]phosphonic acid IUPAC Name: (1-hexadecanoyloxy-1-phosphonoethyl)phosphonic acid Traditional Name: (1-hexadecanoyloxy-1-phosphono-ethyl)phosphonic acid Formula: C18H38O8P2 MolecularWeight: 444.437042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(C)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(C)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C18H38O8P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)26-18(2,27(20,21)22)28(23,24)25/h3-16H2,1-2H3,(H2,20,21,22)(H2,23,24,25)