ethyl 4-methyl-4-oxidanyl-5-phenyl-hept-6-enoate

Systemtic Name: ethyl 4-methyl-4-oxidanyl-5-phenyl-hept-6-enoate Openeye Name: ethyl 4-hydroxy-4-methyl-5-phenyl-hept-6-enoate CAS Name: 4-hydroxy-4-methyl-5-phenyl-6-heptenoic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-4-methyl-5-phenylhept-6-enoate Traditional Name: 4-hydroxy-4-methyl-5-phenyl-hept-6-enoic acid ethyl ester Formula: C16H22O3 MolecularWeight: 262.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)(C(C=C)C1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)CCC(C)(C(C=C)C1=CC=CC=C1)O

InChI

InChI=1S/C16H22O3/c1-4-14(13-9-7-6-8-10-13)16(3,18)12-11-15(17)19-5-2/h4,6-10,14,18H,1,5,11-12H2,2-3H3