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

Systemtic Name: 3-[4-(4-hexadecylpiperazin-1-yl)carbonylphenyl]-2H-1,2,4-oxadiazol-5-one Openeye Name: 3-[4-(4-hexadecylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one CAS Name: 3-[4-[(4-hexadecyl-1-piperazinyl)-oxomethyl]phenyl]-2H-1,2,4-oxadiazol-5-one IUPAC Name: 3-[4-(4-hexadecylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one Traditional Name: 3-[4-(4-cetylpiperazine-1-carbonyl)phenyl]-2H-1,2,4-oxadiazol-5-one Formula: C29H46N4O3 MolecularWeight: 498.70054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=NC(=O)ON3

Isomeric SMILES

CCCCCCCCCCCCCCCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=NC(=O)ON3

InChI

InChI=1S/C29H46N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-32-21-23-33(24-22-32)28(34)26-18-16-25(17-19-26)27-30-29(35)36-31-27/h16-19H,2-15,20-24H2,1H3,(H,30,31,35)