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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC(=C(O3)CCC(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC(=C(O3)CCC(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O3/c23-17-8-6-16(7-9-17)21-19(10-11-20(27)28)29-22(24-21)26-14-12-25(13-15-26)18-4-2-1-3-5-18/h1-9H,10-15H2,(H,27,28)