methyl 3-[3-[(E)-4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)but-1-enyl]oxiran-2-yl]benzoate

Systemtic Name: methyl 3-[3-[(E)-4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)but-1-enyl]oxiran-2-yl]benzoate Openeye Name: methyl 3-[3-[(E)-4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)but-1-enyl]oxiran-2-yl]benzoate CAS Name: 3-[3-[(E)-4-(4-acetyl-3-hydroxy-2-propylphenoxy)but-1-enyl]-2-oxiranyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-[(E)-4-(4-acetyl-3-hydroxy-2-propylphenoxy)but-1-enyl]oxiran-2-yl]benzoate Traditional Name: 3-[3-[(E)-4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)but-1-enyl]oxiran-2-yl]benzoic acid methyl ester Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCC=CC2C(O2)C3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC/C=C/C2C(O2)C3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C25H28O6/c1-4-8-20-21(13-12-19(16(2)26)23(20)27)30-14-6-5-11-22-24(31-22)17-9-7-10-18(15-17)25(28)29-3/h5,7,9-13,15,22,24,27H,4,6,8,14H2,1-3H3/b11-5+