1-[4-(6-methyl-6-oxidanyl-heptoxy)-3-prop-2-enyl-phenyl]-2-oxidanyl-ethanone

Systemtic Name: 1-[4-(6-methyl-6-oxidanyl-heptoxy)-3-prop-2-enyl-phenyl]-2-oxidanyl-ethanone Openeye Name: 1-[3-allyl-4-(6-hydroxy-6-methyl-heptoxy)phenyl]-2-hydroxy-ethanone CAS Name: 2-hydroxy-1-[4-(6-hydroxy-6-methylheptoxy)-3-prop-2-enylphenyl]ethanone IUPAC Name: 2-hydroxy-1-[4-(6-hydroxy-6-methylheptoxy)-3-prop-2-enylphenyl]ethanone Traditional Name: 1-[3-allyl-4-(6-hydroxy-6-methyl-heptoxy)phenyl]-2-hydroxy-ethanone Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCOC1=C(C=C(C=C1)C(=O)CO)CC=C)O

Isomeric SMILES

CC(C)(CCCCCOC1=C(C=C(C=C1)C(=O)CO)CC=C)O

InChI

InChI=1S/C19H28O4/c1-4-8-16-13-15(17(21)14-20)9-10-18(16)23-12-7-5-6-11-19(2,3)22/h4,9-10,13,20,22H,1,5-8,11-12,14H2,2-3H3