1-[2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]tetradecan-1-one

Systemtic Name: 1-[2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]tetradecan-1-one Openeye Name: 1-[2-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]tetradecan-1-one CAS Name: 1-[2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]-1-tetradecanone IUPAC Name: 1-[2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]tetradecan-1-one Traditional Name: 1-[2-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]piperidino]tetradecan-1-one Formula: C28H43N3O2 MolecularWeight: 453.65992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)N1CCCCC1C2=NC(=NO2)C3=CC(=CC=C3)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N1CCCCC1C2=NC(=NO2)C3=CC(=CC=C3)C

InChI

InChI=1S/C28H43N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-20-26(32)31-21-15-14-19-25(31)28-29-27(30-33-28)24-18-16-17-23(2)22-24/h16-18,22,25H,3-15,19-21H2,1-2H3