[4-methoxy-2,6-bis(oxidanyl)-3-[(E)-3-phenylprop-2-enoyl]phenyl] 3-methylbutanoate

Systemtic Name: [4-methoxy-2,6-bis(oxidanyl)-3-[(E)-3-phenylprop-2-enoyl]phenyl] 3-methylbutanoate Openeye Name: [2,6-dihydroxy-4-methoxy-3-[(E)-3-phenylprop-2-enoyl]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2,6-dihydroxy-4-methoxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]phenyl] ester IUPAC Name: [2,6-dihydroxy-4-methoxy-3-[(E)-3-phenylprop-2-enoyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [2,6-dihydroxy-4-methoxy-3-[(E)-3-phenylacryloyl]phenyl] ester Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1=C(C=C(C(=C1O)C(=O)C=CC2=CC=CC=C2)OC)O

Isomeric SMILES

CC(C)CC(=O)OC1=C(C=C(C(=C1O)C(=O)/C=C/C2=CC=CC=C2)OC)O

InChI

InChI=1S/C21H22O6/c1-13(2)11-18(24)27-21-16(23)12-17(26-3)19(20(21)25)15(22)10-9-14-7-5-4-6-8-14/h4-10,12-13,23,25H,11H2,1-3H3/b10-9+