ethyl 3-[4-butoxy-1-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanyl-3-phenyl-cyclohexa-2,5-dien-1-yl]propanoate

Systemtic Name: ethyl 3-[4-butoxy-1-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanyl-3-phenyl-cyclohexa-2,5-dien-1-yl]propanoate Openeye Name: ethyl 3-[4-butoxy-1-(3-ethoxy-3-oxo-propyl)-4-hydroxy-3-phenyl-cyclohexa-2,5-dien-1-yl]propanoate CAS Name: 3-[4-butoxy-1-(3-ethoxy-3-oxopropyl)-4-hydroxy-3-phenyl-1-cyclohexa-2,5-dienyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-butoxy-1-(3-ethoxy-3-oxopropyl)-4-hydroxy-3-phenylcyclohexa-2,5-dien-1-yl]propanoate Traditional Name: 3-[4-butoxy-1-(3-ethoxy-3-keto-propyl)-4-hydroxy-3-phenyl-cyclohexa-2,5-dien-1-yl]propionic acid ethyl ester Formula: C26H36O6 MolecularWeight: 444.56044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(C=CC(C=C1C2=CC=CC=C2)(CCC(=O)OCC)CCC(=O)OCC)O

Isomeric SMILES

CCCCOC1(C=CC(C=C1C2=CC=CC=C2)(CCC(=O)OCC)CCC(=O)OCC)O

InChI

InChI=1S/C26H36O6/c1-4-7-19-32-26(29)18-17-25(15-13-23(27)30-5-2,16-14-24(28)31-6-3)20-22(26)21-11-9-8-10-12-21/h8-12,17-18,20,29H,4-7,13-16,19H2,1-3H3