N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazino]phenyl]cyclohexanecarboxamide Formula: C26H41N3O2 MolecularWeight: 427.62264

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCCC3)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCCC3)CC(C)(C)C

InChI

InChI=1S/C26H41N3O2/c1-20(19-26(2,3)4)18-24(30)29-16-14-28(15-17-29)23-12-10-22(11-13-23)27-25(31)21-8-6-5-7-9-21/h10-13,20-21H,5-9,14-19H2,1-4H3,(H,27,31)