2-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]butane-1,4-diol

Systemtic Name: 2-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]butane-1,4-diol Openeye Name: 2-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]-3-[(4-hydroxy-3-methoxy-phenyl)methyl]butane-1,4-diol CAS Name: 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]butane-1,4-diol IUPAC Name: 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]butane-1,4-diol Traditional Name: 2-(4-hydroxy-3,5-dimethoxy-benzyl)-3-vanillyl-butane-1,4-diol Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO

InChI

InChI=1S/C21H28O7/c1-26-18-8-13(4-5-17(18)24)6-15(11-22)16(12-23)7-14-9-19(27-2)21(25)20(10-14)28-3/h4-5,8-10,15-16,22-25H,6-7,11-12H2,1-3H3