1-[(3R)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]pentan-1-one

Systemtic Name: 1-[(3R)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]pentan-1-one Openeye Name: 1-[(3R)-3-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]pentan-1-one CAS Name: 1-[(3R)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]-1-pentanone IUPAC Name: 1-[(3R)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]pentan-1-one Traditional Name: 1-[(3R)-3-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)piperidino]pentan-1-one Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC(=O)N1CCC[C@H](C1)C2=NC(=NO2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H29N3O2/c1-4-5-8-19(25)24-13-6-7-18(14-24)21-22-20(23-26-21)17-11-9-16(10-12-17)15(2)3/h9-12,15,18H,4-8,13-14H2,1-3H3/t18-/m1/s1