1-[4-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]piperazino]propan-1-one Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4

InChI

InChI=1S/C26H31ClN4O2/c1-2-26(32)31-17-15-30(16-18-31)23-8-11-24(12-9-23)33-25(19-29-14-13-28-20-29)10-5-21-3-6-22(27)7-4-21/h3-4,6-9,11-14,20,25H,2,5,10,15-19H2,1H3