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

Systemtic Name: 6-[(5S)-2-oxidanylidene-5-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]-3-(phenylmethyl)imidazolidin-1-yl]hexylphosphonic acid Openeye Name: 6-[(5S)-3-benzyl-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-2-oxo-imidazolidin-1-yl]hexylphosphonic acid CAS Name: 6-[(5S)-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-3-(phenylmethyl)-1-imidazolidinyl]hexylphosphonic acid IUPAC Name: 6-[(5S)-3-benzyl-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]-2-oxoimidazolidin-1-yl]hexylphosphonic acid Traditional Name: 6-[(5S)-3-benzyl-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-imidazolidin-1-yl]hexylphosphonic acid Formula: C26H35N2O5P MolecularWeight: 486.540261

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)N1CC2=CC=CC=C2)CCCCCCP(=O)(O)O)C=CC(CC3=CC=CC=C3)O

Isomeric SMILES

C1[C@@H](N(C(=O)N1CC2=CC=CC=C2)CCCCCCP(=O)(O)O)/C=C/C(CC3=CC=CC=C3)O

InChI

InChI=1S/C26H35N2O5P/c29-25(19-22-11-5-3-6-12-22)16-15-24-21-27(20-23-13-7-4-8-14-23)26(30)28(24)17-9-1-2-10-18-34(31,32)33/h3-8,11-16,24-25,29H,1-2,9-10,17-21H2,(H2,31,32,33)/b16-15+/t24-,25?/m0/s1