1-[4-(3-bromanylpropyl)-2,4-bis(oxidanyl)-3-propyl-cyclohexa-2,5-dien-1-yl]ethanone

Systemtic Name: 1-[4-(3-bromanylpropyl)-2,4-bis(oxidanyl)-3-propyl-cyclohexa-2,5-dien-1-yl]ethanone Openeye Name: 1-[4-(3-bromopropyl)-2,4-dihydroxy-3-propyl-cyclohexa-2,5-dien-1-yl]ethanone CAS Name: 1-[4-(3-bromopropyl)-2,4-dihydroxy-3-propyl-1-cyclohexa-2,5-dienyl]ethanone IUPAC Name: 1-[4-(3-bromopropyl)-2,4-dihydroxy-3-propylcyclohexa-2,5-dien-1-yl]ethanone Traditional Name: 1-[4-(3-bromopropyl)-2,4-dihydroxy-3-propyl-cyclohexa-2,5-dien-1-yl]ethanone Formula: C14H21BrO3 MolecularWeight: 317.21874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C=CC1(CCCBr)O)C(=O)C)O

Isomeric SMILES

CCCC1=C(C(C=CC1(CCCBr)O)C(=O)C)O

InChI

InChI=1S/C14H21BrO3/c1-3-5-12-13(17)11(10(2)16)6-8-14(12,18)7-4-9-15/h6,8,11,17-18H,3-5,7,9H2,1-2H3