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

Systemtic Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]dodecanamide Openeye Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]dodecanamide CAS Name: N-[4-[4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]phenyl]dodecanamide IUPAC Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]dodecanamide Traditional Name: N-[4-[4-(3,5,5-trimethylhexanoyl)piperazino]phenyl]lauramide Formula: C31H53N3O2 MolecularWeight: 499.77142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H53N3O2/c1-6-7-8-9-10-11-12-13-14-15-29(35)32-27-16-18-28(19-17-27)33-20-22-34(23-21-33)30(36)24-26(2)25-31(3,4)5/h16-19,26H,6-15,20-25H2,1-5H3,(H,32,35)