N-[2-(4-decanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-(4-decanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]-2-phenyl-ethanamide Openeye Name: N-[2-(4-decanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]-2-phenyl-acetamide CAS Name: N-[(4-fluorophenyl)methyl]-N-[2-[4-(1-oxodecyl)-1-piperazinyl]ethyl]-2-phenylacetamide IUPAC Name: N-[2-(4-decanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]-2-phenylacetamide Traditional Name: N-[2-(4-caprylpiperazino)ethyl]-N-(4-fluorobenzyl)-2-phenyl-acetamide Formula: C31H44FN3O2 MolecularWeight: 509.698363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C31H44FN3O2/c1-2-3-4-5-6-7-11-14-30(36)34-22-19-33(20-23-34)21-24-35(26-28-15-17-29(32)18-16-28)31(37)25-27-12-9-8-10-13-27/h8-10,12-13,15-18H,2-7,11,14,19-26H2,1H3