[5-(2-ethylhexoxy)-4-oxidanyl-3-[oxidanyl(phosphonooxy)phosphoryl]oxy-pentyl] prop-2-enoate

Systemtic Name: [5-(2-ethylhexoxy)-4-oxidanyl-3-[oxidanyl(phosphonooxy)phosphoryl]oxy-pentyl] prop-2-enoate Openeye Name: [5-(2-ethylhexoxy)-4-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxy-pentyl] prop-2-enoate CAS Name: 2-propenoic acid [5-(2-ethylhexoxy)-4-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxypentyl] ester IUPAC Name: [5-(2-ethylhexoxy)-4-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxypentyl] prop-2-enoate Traditional Name: acrylic acid [5-(2-ethylhexoxy)-4-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxy-pentyl] ester Formula: C16H32O11P2 MolecularWeight: 462.366202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC(C(CCOC(=O)C=C)OP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

CCCCC(CC)COCC(C(CCOC(=O)C=C)OP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C16H32O11P2/c1-4-7-8-13(5-2)11-24-12-14(17)15(9-10-25-16(18)6-3)26-29(22,23)27-28(19,20)21/h6,13-15,17H,3-5,7-12H2,1-2H3,(H,22,23)(H2,19,20,21)