(2-oxidanyl-1,2,2-triphenyl-ethyl) (Z)-5-ethyl-4,4-dimethyl-3-oxidanyl-hept-5-enoate

Systemtic Name: (2-oxidanyl-1,2,2-triphenyl-ethyl) (Z)-5-ethyl-4,4-dimethyl-3-oxidanyl-hept-5-enoate Openeye Name: (2-hydroxy-1,2,2-triphenyl-ethyl) (Z)-5-ethyl-3-hydroxy-4,4-dimethyl-hept-5-enoate CAS Name: (Z)-5-ethyl-3-hydroxy-4,4-dimethyl-5-heptenoic acid (2-hydroxy-1,2,2-triphenylethyl) ester IUPAC Name: (2-hydroxy-1,2,2-triphenylethyl) (Z)-5-ethyl-3-hydroxy-4,4-dimethylhept-5-enoate Traditional Name: (Z)-5-ethyl-3-hydroxy-4,4-dimethyl-hept-5-enoic acid (2-hydroxy-1,2,2-triphenyl-ethyl) ester Formula: C31H36O4 MolecularWeight: 472.61514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36O4/c1-5-24(6-2)30(3,4)27(32)22-28(33)35-29(23-16-10-7-11-17-23)31(34,25-18-12-8-13-19-25)26-20-14-9-15-21-26/h5,7-21,27,29,32,34H,6,22H2,1-4H3/b24-5-