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

Systemtic Name: 3-methoxy-4-[(3-oxidanyl-4-phenoxycarbonyl-2-propyl-phenoxy)methyl]benzoic acid Openeye Name: 4-[(3-hydroxy-4-phenoxycarbonyl-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid CAS Name: 4-[[3-hydroxy-4-[oxo(phenoxy)methyl]-2-propylphenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(3-hydroxy-4-phenoxycarbonyl-2-propylphenoxy)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(4-carbophenoxy-3-hydroxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Formula: C25H24O7 MolecularWeight: 436.45386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)OC2=CC=CC=C2)OCC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)OC2=CC=CC=C2)OCC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C25H24O7/c1-3-7-19-21(31-15-17-11-10-16(24(27)28)14-22(17)30-2)13-12-20(23(19)26)25(29)32-18-8-5-4-6-9-18/h4-6,8-14,26H,3,7,15H2,1-2H3,(H,27,28)