1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]dodecan-1-one

Systemtic Name: 1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]dodecan-1-one Openeye Name: 1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]dodecan-1-one CAS Name: 1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]-1-dodecanone IUPAC Name: 1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]dodecan-1-one Traditional Name: 1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidino]dodecan-1-one Formula: C25H36BrN3O2 MolecularWeight: 490.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1CCCC(C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCCCCCCC(=O)N1CCCC(C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H36BrN3O2/c1-2-3-4-5-6-7-8-9-10-13-23(30)29-18-11-12-21(19-29)25-27-24(28-31-25)20-14-16-22(26)17-15-20/h14-17,21H,2-13,18-19H2,1H3