1-[2,4,6-tris(oxidanyl)-3-(phenylmethyl)phenyl]nonan-1-one

Systemtic Name: 1-[2,4,6-tris(oxidanyl)-3-(phenylmethyl)phenyl]nonan-1-one Openeye Name: 1-(3-benzyl-2,4,6-trihydroxy-phenyl)nonan-1-one CAS Name: 1-[2,4,6-trihydroxy-3-(phenylmethyl)phenyl]-1-nonanone IUPAC Name: 1-(3-benzyl-2,4,6-trihydroxyphenyl)nonan-1-one Traditional Name: 1-(3-benzyl-2,4,6-trihydroxy-phenyl)nonan-1-one Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1=C(C(=C(C=C1O)O)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCC(=O)C1=C(C(=C(C=C1O)O)CC2=CC=CC=C2)O

InChI

InChI=1S/C22H28O4/c1-2-3-4-5-6-10-13-18(23)21-20(25)15-19(24)17(22(21)26)14-16-11-8-7-9-12-16/h7-9,11-12,15,24-26H,2-6,10,13-14H2,1H3