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

Systemtic Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]propanamide Openeye Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]propanamide CAS Name: N-[4-[4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]propanamide Traditional Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazino]phenyl]propionamide Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O2/c1-6-20(26)23-18-7-9-19(10-8-18)24-11-13-25(14-12-24)21(27)15-17(2)16-22(3,4)5/h7-10,17H,6,11-16H2,1-5H3,(H,23,26)