1-[4-[3-[4-(1H-imidazol-5-ylcarbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one

Systemtic Name: 1-[4-[3-[4-(1H-imidazol-5-ylcarbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one Openeye Name: 1-[4-[3-[4-(1H-imidazole-5-carbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one CAS Name: 1-[4-[3-[4-[1H-imidazol-5-yl(oxo)methyl]-1-piperazinyl]propoxy]phenyl]-1-hexanone IUPAC Name: 1-[4-[3-[4-(1H-imidazole-5-carbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one Traditional Name: 1-[4-[3-[4-(1H-imidazole-5-carbonyl)piperazino]propoxy]phenyl]hexan-1-one Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)C3=CN=CN3

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)C3=CN=CN3

InChI

InChI=1S/C23H32N4O3/c1-2-3-4-6-22(28)19-7-9-20(10-8-19)30-16-5-11-26-12-14-27(15-13-26)23(29)21-17-24-18-25-21/h7-10,17-18H,2-6,11-16H2,1H3,(H,24,25)