3-[4-[4-(2-phenoxypropyl)piperazin-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[4-(2-phenoxypropyl)piperazin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[4-(2-phenoxypropyl)piperazin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[4-(2-phenoxypropyl)-1-piperazinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[4-(2-phenoxypropyl)piperazin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[4-(2-phenoxypropyl)piperazino]phenyl]propionic acid Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C2=CC=C(C=C2)CCC(=O)O)OC3=CC=CC=C3

Isomeric SMILES

CC(CN1CCN(CC1)C2=CC=C(C=C2)CCC(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3/c1-18(27-21-5-3-2-4-6-21)17-23-13-15-24(16-14-23)20-10-7-19(8-11-20)9-12-22(25)26/h2-8,10-11,18H,9,12-17H2,1H3,(H,25,26)