6-[(5S)-3-methyl-2-oxidanylidene-5-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]imidazolidin-1-yl]hexylphosphonic acid

Systemtic Name: 6-[(5S)-3-methyl-2-oxidanylidene-5-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]imidazolidin-1-yl]hexylphosphonic acid Openeye Name: 6-[(5S)-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-3-methyl-2-oxo-imidazolidin-1-yl]hexylphosphonic acid CAS Name: 6-[(5S)-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]-3-methyl-2-oxo-1-imidazolidinyl]hexylphosphonic acid IUPAC Name: 6-[(5S)-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]-3-methyl-2-oxoimidazolidin-1-yl]hexylphosphonic acid Traditional Name: 6-[(5S)-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-3-methyl-imidazolidin-1-yl]hexylphosphonic acid Formula: C20H31N2O5P MolecularWeight: 410.444301

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(N(C1=O)CCCCCCP(=O)(O)O)C=CC(CC2=CC=CC=C2)O

Isomeric SMILES

CN1C[C@@H](N(C1=O)CCCCCCP(=O)(O)O)/C=C/C(CC2=CC=CC=C2)O

InChI

InChI=1S/C20H31N2O5P/c1-21-16-18(11-12-19(23)15-17-9-5-4-6-10-17)22(20(21)24)13-7-2-3-8-14-28(25,26)27/h4-6,9-12,18-19,23H,2-3,7-8,13-16H2,1H3,(H2,25,26,27)/b12-11+/t18-,19?/m0/s1