N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3,5,5-trimethyl-hexanamide

Systemtic Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3,5,5-trimethyl-hexanamide Openeye Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3,5,5-trimethyl-hexanamide CAS Name: N-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]-3,5,5-trimethylhexanamide IUPAC Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3,5,5-trimethylhexanamide Traditional Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]-3,5,5-trimethyl-hexanamide Formula: C25H41N3O2 MolecularWeight: 415.61194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H41N3O2/c1-19(17-24(2,3)4)16-22(29)26-20-8-10-21(11-9-20)27-12-14-28(15-13-27)23(30)18-25(5,6)7/h8-11,19H,12-18H2,1-7H3,(H,26,29)