(2-oxidanyl-1,2,2-triphenyl-ethyl) 3,6-dimethyl-3-oxidanyl-hept-5-enoate

Systemtic Name: (2-oxidanyl-1,2,2-triphenyl-ethyl) 3,6-dimethyl-3-oxidanyl-hept-5-enoate Openeye Name: (2-hydroxy-1,2,2-triphenyl-ethyl) 3-hydroxy-3,6-dimethyl-hept-5-enoate CAS Name: 3-hydroxy-3,6-dimethyl-5-heptenoic acid (2-hydroxy-1,2,2-triphenylethyl) ester IUPAC Name: (2-hydroxy-1,2,2-triphenylethyl) 3-hydroxy-3,6-dimethylhept-5-enoate Traditional Name: 3-hydroxy-3,6-dimethyl-hept-5-enoic acid (2-hydroxy-1,2,2-triphenyl-ethyl) ester Formula: C29H32O4 MolecularWeight: 444.56198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(C)(CC(=O)OC(C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)O)C

Isomeric SMILES

CC(=CCC(C)(CC(=O)OC(C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)O)C

InChI

InChI=1S/C29H32O4/c1-22(2)19-20-28(3,31)21-26(30)33-27(23-13-7-4-8-14-23)29(32,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-19,27,31-32H,20-21H2,1-3H3