2-[4-(4-chlorophenyl)-1,3-oxazol-5-yl]-2-(4-phenylpiperazin-1-yl)propanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)-1,3-oxazol-5-yl]-2-(4-phenylpiperazin-1-yl)propanoic acid Openeye Name: 2-[4-(4-chlorophenyl)oxazol-5-yl]-2-(4-phenylpiperazin-1-yl)propanoic acid CAS Name: 2-[4-(4-chlorophenyl)-5-oxazolyl]-2-(4-phenyl-1-piperazinyl)propanoic acid IUPAC Name: 2-[4-(4-chlorophenyl)-1,3-oxazol-5-yl]-2-(4-phenylpiperazin-1-yl)propanoic acid Traditional Name: 2-[4-(4-chlorophenyl)oxazol-5-yl]-2-(4-phenylpiperazino)propionic acid Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N=CO1)C2=CC=C(C=C2)Cl)(C(=O)O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C1=C(N=CO1)C2=CC=C(C=C2)Cl)(C(=O)O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H22ClN3O3/c1-22(21(27)28,20-19(24-15-29-20)16-7-9-17(23)10-8-16)26-13-11-25(12-14-26)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,27,28)