2-(hydroxymethyl)-1-(2-oxidanyl-4-phenylmethoxy-phenyl)butan-1-one

Systemtic Name: 2-(hydroxymethyl)-1-(2-oxidanyl-4-phenylmethoxy-phenyl)butan-1-one Openeye Name: 1-(4-benzyloxy-2-hydroxy-phenyl)-2-(hydroxymethyl)butan-1-one CAS Name: 2-(hydroxymethyl)-1-(2-hydroxy-4-phenylmethoxyphenyl)-1-butanone IUPAC Name: 2-(hydroxymethyl)-1-(2-hydroxy-4-phenylmethoxyphenyl)butan-1-one Traditional Name: 1-(4-benzoxy-2-hydroxy-phenyl)-2-methylol-butan-1-one Formula: C18H20O4 MolecularWeight: 300.349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCC(CO)C(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C18H20O4/c1-2-14(11-19)18(21)16-9-8-15(10-17(16)20)22-12-13-6-4-3-5-7-13/h3-10,14,19-20H,2,11-12H2,1H3