bicyclo[4.1.0]hepta-1,3,5-triene; methyl-(5-oxidanylidene-5-phenylmethoxy-2-phenylmethoxycarbonyl-pentyl)phosphinic acid

Systemtic Name: bicyclo[4.1.0]hepta-1,3,5-triene; methyl-(5-oxidanylidene-5-phenylmethoxy-2-phenylmethoxycarbonyl-pentyl)phosphinic acid Openeye Name: (5-benzyloxy-2-benzyloxycarbonyl-5-oxo-pentyl)-methyl-phosphinic acid; bicyclo[4.1.0]hepta-1,3,5-triene CAS Name: bicyclo[4.1.0]hepta-1,3,5-triene; methyl-(5-oxo-5-phenylmethoxy-2-phenylmethoxycarbonylpentyl)phosphinic acid IUPAC Name: bicyclo[4.1.0]hepta-1,3,5-triene; methyl-(5-oxo-5-phenylmethoxy-2-phenylmethoxycarbonylpentyl)phosphinic acid Traditional Name: (5-benzoxy-2-carbobenzoxy-5-keto-pentyl)-methyl-phosphinic acid; bicyclo[4.1.0]hepta-1,3,5-triene Formula: C28H31O6P MolecularWeight: 494.515901

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(CC(CCC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)O.C1C2=CC=CC=C21

Isomeric SMILES

CP(=O)(CC(CCC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)O.C1C2=CC=CC=C21

InChI

InChI=1S/C21H25O6P.C7H6/c1-28(24,25)16-19(21(23)27-15-18-10-6-3-7-11-18)12-13-20(22)26-14-17-8-4-2-5-9-17;1-2-4-7-5-6(7)3-1/h2-11,19H,12-16H2,1H3,(H,24,25);1-4H,5H2