1-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-2-ethyl-hexan-1-one

Systemtic Name: 1-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-2-ethyl-hexan-1-one Openeye Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[4-[3H-benzimidazol-5-yl(oxo)methyl]-1-piperazinyl]-2-ethyl-1-hexanone IUPAC Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazino]-2-ethyl-hexan-1-one Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C20H28N4O2/c1-3-5-6-15(4-2)19(25)23-9-11-24(12-10-23)20(26)16-7-8-17-18(13-16)22-14-21-17/h7-8,13-15H,3-6,9-12H2,1-2H3,(H,21,22)