3-methoxy-4-[[3-oxidanyl-4-(phenylcarbonyl)-2-propyl-phenoxy]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[3-oxidanyl-4-(phenylcarbonyl)-2-propyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[(4-benzoyl-3-hydroxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid CAS Name: 4-[(4-benzoyl-3-hydroxy-2-propylphenoxy)methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(4-benzoyl-3-hydroxy-2-propylphenoxy)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(4-benzoyl-3-hydroxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Formula: C25H24O6 MolecularWeight: 420.45446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2)OCC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2)OCC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C25H24O6/c1-3-7-19-21(31-15-18-11-10-17(25(28)29)14-22(18)30-2)13-12-20(24(19)27)23(26)16-8-5-4-6-9-16/h4-6,8-14,27H,3,7,15H2,1-2H3,(H,28,29)