methyl 5-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-5-oxidanylidene-4-phenyl-pentanoate

Systemtic Name: methyl 5-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-5-oxidanylidene-4-phenyl-pentanoate Openeye Name: methyl 5-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-5-oxo-4-phenyl-pentanoate CAS Name: 5-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-5-oxo-4-phenylpentanoic acid methyl ester IUPAC Name: methyl 5-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-5-oxo-4-phenylpentanoate Traditional Name: 5-keto-4-phenyl-5-(3-piperonyloxyphenyl)valeric acid methyl ester Formula: C26H24O6 MolecularWeight: 432.46516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)OCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)CCC(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)OCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H24O6/c1-29-25(27)13-11-22(19-6-3-2-4-7-19)26(28)20-8-5-9-21(15-20)30-16-18-10-12-23-24(14-18)32-17-31-23/h2-10,12,14-15,22H,11,13,16-17H2,1H3