2-(1,3-benzodioxol-5-yl)-1-[2,4-bis(oxidanyl)-5-propyl-phenyl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2,4-bis(oxidanyl)-5-propyl-phenyl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-(2,4-dihydroxy-5-propyl-phenyl)ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-(2,4-dihydroxy-5-propylphenyl)ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-(2,4-dihydroxy-5-propylphenyl)ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-(2,4-dihydroxy-5-propyl-phenyl)ethanone Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)C(=O)CC2=CC3=C(C=C2)OCO3)O)O

Isomeric SMILES

CCCC1=C(C=C(C(=C1)C(=O)CC2=CC3=C(C=C2)OCO3)O)O

InChI

InChI=1S/C18H18O5/c1-2-3-12-8-13(16(21)9-14(12)19)15(20)6-11-4-5-17-18(7-11)23-10-22-17/h4-5,7-9,19,21H,2-3,6,10H2,1H3