methyl 3-[2-(3,4-dipentoxyphenyl)-6-(3-methylperoxy-3-oxidanylidene-propyl)phenyl]benzoate

Systemtic Name: methyl 3-[2-(3,4-dipentoxyphenyl)-6-(3-methylperoxy-3-oxidanylidene-propyl)phenyl]benzoate Openeye Name: methyl 3-[2-(3,4-dipentoxyphenyl)-6-(3-methylperoxy-3-oxo-propyl)phenyl]benzoate CAS Name: 3-[2-(3,4-dipentoxyphenyl)-6-(3-methyldioxy-3-oxopropyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(3,4-dipentoxyphenyl)-6-(3-methylperoxy-3-oxopropyl)phenyl]benzoate Traditional Name: 3-[2-(3,4-diamoxyphenyl)-6-(3-keto-3-methylperoxy-propyl)phenyl]benzoic acid methyl ester Formula: C34H42O7 MolecularWeight: 562.69308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C2=C(C(=CC=C2)CCC(=O)OOC)C3=CC(=CC=C3)C(=O)OC)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C2=C(C(=CC=C2)CCC(=O)OOC)C3=CC(=CC=C3)C(=O)OC)OCCCCC

InChI

InChI=1S/C34H42O7/c1-5-7-9-21-39-30-19-17-26(24-31(30)40-22-10-8-6-2)29-16-12-13-25(18-20-32(35)41-38-4)33(29)27-14-11-15-28(23-27)34(36)37-3/h11-17,19,23-24H,5-10,18,20-22H2,1-4H3