4-[3-(hydroxymethyl)phenyl]-2,3,7-trimethoxy-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 4-[3-(hydroxymethyl)phenyl]-2,3,7-trimethoxy-cyclohepta-2,4,6-trien-1-one Openeye Name: 4-[3-(hydroxymethyl)phenyl]-2,3,7-trimethoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 4-[3-(hydroxymethyl)phenyl]-2,3,7-trimethoxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 4-[3-(hydroxymethyl)phenyl]-2,3,7-trimethoxycyclohepta-2,4,6-trien-1-one Traditional Name: 2,3,7-trimethoxy-4-(3-methylolphenyl)cyclohepta-2,4,6-trien-1-one Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C(=C(C1=O)OC)OC)C2=CC(=CC=C2)CO

Isomeric SMILES

COC1=CC=C(C(=C(C1=O)OC)OC)C2=CC(=CC=C2)CO

InChI

InChI=1S/C17H18O5/c1-20-14-8-7-13(12-6-4-5-11(9-12)10-18)16(21-2)17(22-3)15(14)19/h4-9,18H,10H2,1-3H3