(2,6-ditert-butyl-4-methoxy-phenyl) (3S)-3-methyl-2-oxidanylidene-5-phenylmethoxy-pentanoate

Systemtic Name: (2,6-ditert-butyl-4-methoxy-phenyl) (3S)-3-methyl-2-oxidanylidene-5-phenylmethoxy-pentanoate Openeye Name: (2,6-ditert-butyl-4-methoxy-phenyl) (3S)-5-benzyloxy-3-methyl-2-oxo-pentanoate CAS Name: (3S)-3-methyl-2-oxo-5-phenylmethoxypentanoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methoxyphenyl) (3S)-3-methyl-2-oxo-5-phenylmethoxypentanoate Traditional Name: (3S)-5-benzoxy-2-keto-3-methyl-valeric acid (2,6-ditert-butyl-4-methoxy-phenyl) ester Formula: C28H38O5 MolecularWeight: 454.59832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOCC1=CC=CC=C1)C(=O)C(=O)OC2=C(C=C(C=C2C(C)(C)C)OC)C(C)(C)C

Isomeric SMILES

C[C@@H](CCOCC1=CC=CC=C1)C(=O)C(=O)OC2=C(C=C(C=C2C(C)(C)C)OC)C(C)(C)C

InChI

InChI=1S/C28H38O5/c1-19(14-15-32-18-20-12-10-9-11-13-20)24(29)26(30)33-25-22(27(2,3)4)16-21(31-8)17-23(25)28(5,6)7/h9-13,16-17,19H,14-15,18H2,1-8H3/t19-/m0/s1