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

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

Systemtic Name:4-[4-[3-(2-methylphenoxy)propanoyl]piperazin-1-yl]benzoic acid
Openeye Name:4-[4-[3-(2-methylphenoxy)propanoyl]piperazin-1-yl]benzoic acid
CAS Name:4-[4-[3-(2-methylphenoxy)-1-oxopropyl]-1-piperazinyl]benzoic acid
IUPAC Name:4-[4-[3-(2-methylphenoxy)propanoyl]piperazin-1-yl]benzoic acid
Traditional Name:4-[4-[3-(2-methylphenoxy)propanoyl]piperazino]benzoic acid
Formula: C21H24N2O4
MolecularWeight: 368.42626
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)O


Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C21H24N2O4/c1-16-4-2-3-5-19(16)27-15-10-20(24)23-13-11-22(12-14-23)18-8-6-17(7-9-18)21(25)26/h2-9H,10-15H2,1H3,(H,25,26)


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