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

Systemtic Name: 1-[4-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]piperazin-1-yl]hexan-1-one Openeye Name: 1-[4-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]piperazin-1-yl]hexan-1-one CAS Name: 1-[4-[4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]-1-piperazinyl]-1-hexanone IUPAC Name: 1-[4-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]piperazin-1-yl]hexan-1-one Traditional Name: 1-[4-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]piperazino]hexan-1-one Formula: C29H37ClN4O2 MolecularWeight: 509.08268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37ClN4O2/c1-2-3-4-5-29(35)34-20-18-33(19-21-34)26-11-14-27(15-12-26)36-28(22-32-17-16-31-23-32)13-8-24-6-9-25(30)10-7-24/h6-7,9-12,14-17,23,28H,2-5,8,13,18-22H2,1H3