[2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 2-phenylbutanoate

Systemtic Name: [2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 2-phenylbutanoate Openeye Name: [2-methoxy-4-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [4-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC2=C(C=C(C=C2)C=CC(=O)OC)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OC2=C(C=C(C=C2)/C=C/C(=O)OC)OC

InChI

InChI=1S/C21H22O5/c1-4-17(16-8-6-5-7-9-16)21(23)26-18-12-10-15(14-19(18)24-2)11-13-20(22)25-3/h5-14,17H,4H2,1-3H3/b13-11+