5-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-phenethyl-2-phenyl-3H-pyran-6-one

Systemtic Name: 5-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-phenethyl-2-phenyl-3H-pyran-6-one Openeye Name: 5-[(4-hydroxy-3-methoxy-phenyl)methyl]-2-phenethyl-2-phenyl-3H-pyran-6-one CAS Name: 5-[(4-hydroxy-3-methoxyphenyl)methyl]-2-phenethyl-2-phenyl-3H-pyran-6-one IUPAC Name: 5-[(4-hydroxy-3-methoxyphenyl)methyl]-2-phenethyl-2-phenyl-3H-pyran-6-one Traditional Name: 2-phenethyl-2-phenyl-5-vanillyl-3H-pyran-6-one Formula: C27H26O4 MolecularWeight: 414.49294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=CCC(OC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=CCC(OC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C27H26O4/c1-30-25-19-21(12-13-24(25)28)18-22-15-17-27(31-26(22)29,23-10-6-3-7-11-23)16-14-20-8-4-2-5-9-20/h2-13,15,19,28H,14,16-18H2,1H3