(2S)-N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-2-ethyl-hexanamide

Systemtic Name: (2S)-N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-2-ethyl-hexanamide Openeye Name: (2S)-N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-2-ethyl-hexanamide CAS Name: (2S)-N-[4-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazinyl]phenyl]-2-ethylhexanamide IUPAC Name: (2S)-N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-2-ethylhexanamide Traditional Name: (2S)-N-[4-[4-(3-cyclopentylpropanoyl)piperazino]phenyl]-2-ethyl-hexanamide Formula: C26H41N3O2 MolecularWeight: 427.62264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCC3CCCC3

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCC3CCCC3

InChI

InChI=1S/C26H41N3O2/c1-3-5-10-22(4-2)26(31)27-23-12-14-24(15-13-23)28-17-19-29(20-18-28)25(30)16-11-21-8-6-7-9-21/h12-15,21-22H,3-11,16-20H2,1-2H3,(H,27,31)/t22-/m0/s1