[(E)-4-(2-ethoxycarbonylpyrrolidin-3-yl)-4-ethyl-hex-2-enyl]phosphonic acid

Systemtic Name: [(E)-4-(2-ethoxycarbonylpyrrolidin-3-yl)-4-ethyl-hex-2-enyl]phosphonic acid Openeye Name: [(E)-4-(2-ethoxycarbonylpyrrolidin-3-yl)-4-ethyl-hex-2-enyl]phosphonic acid CAS Name: [(E)-4-(2-ethoxycarbonyl-3-pyrrolidinyl)-4-ethylhex-2-enyl]phosphonic acid IUPAC Name: [(E)-4-(2-ethoxycarbonylpyrrolidin-3-yl)-4-ethylhex-2-enyl]phosphonic acid Traditional Name: [(E)-4-(2-carbethoxypyrrolidin-3-yl)-4-ethyl-hex-2-enyl]phosphonic acid Formula: C15H28NO5P MolecularWeight: 333.360281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C=CCP(=O)(O)O)C1CCNC1C(=O)OCC

Isomeric SMILES

CCC(CC)(/C=C/CP(=O)(O)O)C1CCNC1C(=O)OCC

InChI

InChI=1S/C15H28NO5P/c1-4-15(5-2,9-7-11-22(18,19)20)12-8-10-16-13(12)14(17)21-6-3/h7,9,12-13,16H,4-6,8,10-11H2,1-3H3,(H2,18,19,20)/b9-7+