5-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]benzoic acid CAS Name: 2-hydroxy-5-[4-[3-(2-methoxyphenoxy)-1-oxopropyl]-1-piperazinyl]benzoic acid IUPAC Name: 2-hydroxy-5-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]benzoic acid Traditional Name: 2-hydroxy-5-[4-[3-(2-methoxyphenoxy)propanoyl]piperazino]benzoic acid Formula: C21H24N2O6 MolecularWeight: 400.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1OCCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C21H24N2O6/c1-28-18-4-2-3-5-19(18)29-13-8-20(25)23-11-9-22(10-12-23)15-6-7-17(24)16(14-15)21(26)27/h2-7,14,24H,8-13H2,1H3,(H,26,27)