(phenylmethyl) 3-[4-bis[2-tert-butyl-4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenoxy]phosphanyloxy-3-tert-butyl-phenyl]propanoate

Systemtic Name: (phenylmethyl) 3-[4-bis[2-tert-butyl-4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenoxy]phosphanyloxy-3-tert-butyl-phenyl]propanoate Openeye Name: benzyl 3-[4-bis[4-(3-benzyloxy-3-oxo-propyl)-2-tert-butyl-phenoxy]phosphanyloxy-3-tert-butyl-phenyl]propanoate CAS Name: 3-[4-bis[2-tert-butyl-4-(3-oxo-3-phenylmethoxypropyl)phenoxy]phosphinooxy-3-tert-butylphenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[4-bis[2-tert-butyl-4-(3-oxo-3-phenylmethoxypropyl)phenoxy]phosphanyloxy-3-tert-butylphenyl]propanoate Traditional Name: 3-[4-bis[4-(3-benzoxy-3-keto-propyl)-2-tert-butyl-phenoxy]phosphinooxy-3-tert-butyl-phenyl]propionic acid benzyl ester Formula: C60H69O9P MolecularWeight: 965.158221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)CCC(=O)OCC2=CC=CC=C2)OP(OC3=C(C=C(C=C3)CCC(=O)OCC4=CC=CC=C4)C(C)(C)C)OC5=C(C=C(C=C5)CCC(=O)OCC6=CC=CC=C6)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)CCC(=O)OCC2=CC=CC=C2)OP(OC3=C(C=C(C=C3)CCC(=O)OCC4=CC=CC=C4)C(C)(C)C)OC5=C(C=C(C=C5)CCC(=O)OCC6=CC=CC=C6)C(C)(C)C

InChI

InChI=1S/C60H69O9P/c1-58(2,3)49-37-43(28-34-55(61)64-40-46-19-13-10-14-20-46)25-31-52(49)67-70(68-53-32-26-44(38-50(53)59(4,5)6)29-35-56(62)65-41-47-21-15-11-16-22-47)69-54-33-27-45(39-51(54)60(7,8)9)30-36-57(63)66-42-48-23-17-12-18-24-48/h10-27,31-33,37-39H,28-30,34-36,40-42H2,1-9H3