3-bromanyl-4-[3-(4-ethanoyl-3-propanoyloxy-2-propyl-phenoxy)propoxy]benzoic acid

Systemtic Name: 3-bromanyl-4-[3-(4-ethanoyl-3-propanoyloxy-2-propyl-phenoxy)propoxy]benzoic acid Openeye Name: 4-[3-(4-acetyl-3-propanoyloxy-2-propyl-phenoxy)propoxy]-3-bromo-benzoic acid CAS Name: 4-[3-[4-acetyl-3-(1-oxopropoxy)-2-propylphenoxy]propoxy]-3-bromobenzoic acid IUPAC Name: 4-[3-(4-acetyl-3-propanoyloxy-2-propylphenoxy)propoxy]-3-bromobenzoic acid Traditional Name: 4-[3-(4-acetyl-3-propionyloxy-2-propyl-phenoxy)propoxy]-3-bromo-benzoic acid Formula: C24H27BrO7 MolecularWeight: 507.37098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC(=O)CC)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)O)Br

Isomeric SMILES

CCCC1=C(C=CC(=C1OC(=O)CC)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C24H27BrO7/c1-4-7-18-20(11-9-17(15(3)26)23(18)32-22(27)5-2)30-12-6-13-31-21-10-8-16(24(28)29)14-19(21)25/h8-11,14H,4-7,12-13H2,1-3H3,(H,28,29)