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

Systemtic Name: [4-methoxy-2,6-bis(oxidanyl)-3-[(E)-3-phenylprop-2-enoyl]phenyl] 2-methylbutanoate Openeye Name: [2,6-dihydroxy-4-methoxy-3-[(E)-3-phenylprop-2-enoyl]phenyl] 2-methylbutanoate CAS Name: 2-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] 2-methylbutanoate Traditional Name: 2-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22O6/c1-4-13(2)21(25)27-20-16(23)12-17(26-3)18(19(20)24)15(22)11-10-14-8-6-5-7-9-14/h5-13,23-24H,4H2,1-3H3/b11-10+