1-[3,4-bis(oxidanyl)phenyl]-3-ethyl-heptan-1-one

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-3-ethyl-heptan-1-one Openeye Name: 1-(3,4-dihydroxyphenyl)-3-ethyl-heptan-1-one CAS Name: 1-(3,4-dihydroxyphenyl)-3-ethyl-1-heptanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-3-ethylheptan-1-one Traditional Name: 1-(3,4-dihydroxyphenyl)-3-ethyl-heptan-1-one Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-3-5-6-11(4-2)9-14(17)12-7-8-13(16)15(18)10-12/h7-8,10-11,16,18H,3-6,9H2,1-2H3