3-[4-(4-octadecylpiperazin-1-yl)carbonylphenyl]-2H-1,2,4-oxadiazol-5-one

Systemtic Name: 3-[4-(4-octadecylpiperazin-1-yl)carbonylphenyl]-2H-1,2,4-oxadiazol-5-one Openeye Name: 3-[4-(4-octadecylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one CAS Name: 3-[4-[(4-octadecyl-1-piperazinyl)-oxomethyl]phenyl]-2H-1,2,4-oxadiazol-5-one IUPAC Name: 3-[4-(4-octadecylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one Traditional Name: 3-[4-(4-stearylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one Formula: C31H50N4O3 MolecularWeight: 526.7537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=NC(=O)ON3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=NC(=O)ON3

InChI

InChI=1S/C31H50N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-34-23-25-35(26-24-34)30(36)28-20-18-27(19-21-28)29-32-31(37)38-33-29/h18-21H,2-17,22-26H2,1H3,(H,32,33,37)