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

Systemtic Name: 3-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]benzoic acid Openeye Name: 3-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]benzoic acid CAS Name: 3-[4-[3-(2-methoxyphenoxy)-1-oxopropyl]-1-piperazinyl]benzoic acid IUPAC Name: 3-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]benzoic acid Traditional Name: 3-[4-[3-(2-methoxyphenoxy)propanoyl]piperazino]benzoic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-27-18-7-2-3-8-19(18)28-14-9-20(24)23-12-10-22(11-13-23)17-6-4-5-16(15-17)21(25)26/h2-8,15H,9-14H2,1H3,(H,25,26)