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

Systemtic Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]octanamide Openeye Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]octanamide CAS Name: N-[4-[4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]phenyl]octanamide IUPAC Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]octanamide Traditional Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazino]phenyl]caprylamide Formula: C27H45N3O2 MolecularWeight: 443.6651

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C27H45N3O2/c1-6-7-8-9-10-11-25(31)28-23-12-14-24(15-13-23)29-16-18-30(19-17-29)26(32)20-22(2)21-27(3,4)5/h12-15,22H,6-11,16-21H2,1-5H3,(H,28,31)