ethyl (E,4R,5R)-4,6,6-trimethyl-5-oxidanyl-7-phenylmethoxy-hept-2-enoate

Systemtic Name: ethyl (E,4R,5R)-4,6,6-trimethyl-5-oxidanyl-7-phenylmethoxy-hept-2-enoate Openeye Name: ethyl (E,4R,5R)-7-benzyloxy-5-hydroxy-4,6,6-trimethyl-hept-2-enoate CAS Name: (E,4R,5R)-5-hydroxy-4,6,6-trimethyl-7-phenylmethoxy-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E,4R,5R)-5-hydroxy-4,6,6-trimethyl-7-phenylmethoxyhept-2-enoate Traditional Name: (E,4R,5R)-7-benzoxy-5-hydroxy-4,6,6-trimethyl-hept-2-enoic acid ethyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C)C(C(C)(C)COCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)/C=C/[C@@H](C)[C@H](C(C)(C)COCC1=CC=CC=C1)O

InChI

InChI=1S/C19H28O4/c1-5-23-17(20)12-11-15(2)18(21)19(3,4)14-22-13-16-9-7-6-8-10-16/h6-12,15,18,21H,5,13-14H2,1-4H3/b12-11+/t15-,18-/m1/s1