sodium [(E)-heptadec-1-enoxy]-[oxidanyl(phosphono)methyl]phosphinate

Systemtic Name: sodium [(E)-heptadec-1-enoxy]-[oxidanyl(phosphono)methyl]phosphinate Openeye Name: sodium [(E)-heptadec-1-enoxy]-[hydroxy(phosphono)methyl]phosphinate CAS Name: sodium [(E)-heptadec-1-enoxy]-[hydroxy(phosphono)methyl]phosphinate IUPAC Name: sodium [(E)-heptadec-1-enoxy]-[hydroxy(phosphono)methyl]phosphinate Traditional Name: sodium [(E)-heptadec-1-enoxy]-[hydroxy(phosphono)methyl]phosphinate Formula: C18H37NaO7P2 MolecularWeight: 450.419472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=COP(=O)(C(O)P(=O)(O)O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/OP(=O)(C(O)P(=O)(O)O)[O-].[Na+]

InChI

InChI=1S/C18H38O7P2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-27(23,24)18(19)26(20,21)22;/h16-19H,2-15H2,1H3,(H,23,24)(H2,20,21,22);/q;+1/p-1/b17-16+;