[1,7-bis(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-heptan-3-yl] ethanoate

Systemtic Name: [1,7-bis(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-heptan-3-yl] ethanoate Openeye Name: [5-(4-hydroxy-3-methoxy-phenyl)-1-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]-3-oxo-pentyl] acetate CAS Name: acetic acid [1,7-bis(4-hydroxy-3-methoxyphenyl)-5-oxoheptan-3-yl] ester IUPAC Name: [1,7-bis(4-hydroxy-3-methoxyphenyl)-5-oxoheptan-3-yl] acetate Traditional Name: acetic acid [1-homovanillyl-5-(4-hydroxy-3-methoxy-phenyl)-3-keto-pentyl] ester Formula: C23H28O7 MolecularWeight: 416.46422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCC1=CC(=C(C=C1)O)OC)CC(=O)CCC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CC(=O)OC(CCC1=CC(=C(C=C1)O)OC)CC(=O)CCC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C23H28O7/c1-15(24)30-19(9-5-17-7-11-21(27)23(13-17)29-3)14-18(25)8-4-16-6-10-20(26)22(12-16)28-2/h6-7,10-13,19,26-27H,4-5,8-9,14H2,1-3H3