2-[3-(4-hydroxyphenyl)propanoyl]-3-methoxy-6-(3-methylbut-2-enyl)-5-oxidanyl-phenolate

Systemtic Name: 2-[3-(4-hydroxyphenyl)propanoyl]-3-methoxy-6-(3-methylbut-2-enyl)-5-oxidanyl-phenolate Openeye Name: 5-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]-3-methoxy-6-(3-methylbut-2-enyl)phenolate CAS Name: 5-hydroxy-2-[3-(4-hydroxyphenyl)-1-oxopropyl]-3-methoxy-6-(3-methylbut-2-enyl)phenolate IUPAC Name: 5-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]-3-methoxy-6-(3-methylbut-2-enyl)phenolate Traditional Name: 5-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]-3-methoxy-6-(3-methylbut-2-enyl)phenolate Formula: C21H23O5- MolecularWeight: 355.40432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C(=C1[O-])C(=O)CCC2=CC=C(C=C2)O)OC)O)C

Isomeric SMILES

CC(=CCC1=C(C=C(C(=C1[O-])C(=O)CCC2=CC=C(C=C2)O)OC)O)C

InChI

InChI=1S/C21H24O5/c1-13(2)4-10-16-18(24)12-19(26-3)20(21(16)25)17(23)11-7-14-5-8-15(22)9-6-14/h4-6,8-9,12,22,24-25H,7,10-11H2,1-3H3/p-1