O1-(3-methyl-3-oxidanyl-hex-5-enyl) O6-phenacyl hexanedioate

Systemtic Name: O1-(3-methyl-3-oxidanyl-hex-5-enyl) O6-phenacyl hexanedioate Openeye Name: O1-(3-hydroxy-3-methyl-hex-5-enyl) O6-phenacyl hexanedioate CAS Name: hexanedioic acid O1-(3-hydroxy-3-methylhex-5-enyl) ester O6-phenacyl ester IUPAC Name: 1-O-(3-hydroxy-3-methylhex-5-enyl) 6-O-phenacyl hexanedioate Traditional Name: adipic acid O1-(3-hydroxy-3-methyl-hex-5-enyl) ester O6-phenacyl ester Formula: C21H28O6 MolecularWeight: 376.44342

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)CCCCC(=O)OCC(=O)C1=CC=CC=C1)(CC=C)O

Isomeric SMILES

CC(CCOC(=O)CCCCC(=O)OCC(=O)C1=CC=CC=C1)(CC=C)O

InChI

InChI=1S/C21H28O6/c1-3-13-21(2,25)14-15-26-19(23)11-7-8-12-20(24)27-16-18(22)17-9-5-4-6-10-17/h3-6,9-10,25H,1,7-8,11-16H2,2H3