ethyl (3S,5R)-4,4-dimethyl-3,5-bis(oxidanyl)-7-phenyl-heptanoate

Systemtic Name: ethyl (3S,5R)-4,4-dimethyl-3,5-bis(oxidanyl)-7-phenyl-heptanoate Openeye Name: ethyl (3S,5R)-3,5-dihydroxy-4,4-dimethyl-7-phenyl-heptanoate CAS Name: (3S,5R)-3,5-dihydroxy-4,4-dimethyl-7-phenylheptanoic acid ethyl ester IUPAC Name: ethyl (3S,5R)-3,5-dihydroxy-4,4-dimethyl-7-phenylheptanoate Traditional Name: (3S,5R)-3,5-dihydroxy-4,4-dimethyl-7-phenyl-enanthic acid ethyl ester Formula: C17H26O4 MolecularWeight: 294.38594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)(C)C(CCC1=CC=CC=C1)O)O

Isomeric SMILES

CCOC(=O)C[C@@H](C(C)(C)[C@@H](CCC1=CC=CC=C1)O)O

InChI

InChI=1S/C17H26O4/c1-4-21-16(20)12-15(19)17(2,3)14(18)11-10-13-8-6-5-7-9-13/h5-9,14-15,18-19H,4,10-12H2,1-3H3/t14-,15+/m1/s1