1-[4-[(2R)-3-azanyl-2-oxidanyl-propyl]piperazin-1-yl]-2-ethyl-butan-1-one

Systemtic Name: 1-[4-[(2R)-3-azanyl-2-oxidanyl-propyl]piperazin-1-yl]-2-ethyl-butan-1-one Openeye Name: 1-[4-[(2R)-3-amino-2-hydroxy-propyl]piperazin-1-yl]-2-ethyl-butan-1-one CAS Name: 1-[4-[(2R)-3-amino-2-hydroxypropyl]-1-piperazinyl]-2-ethyl-1-butanone IUPAC Name: 1-[4-[(2R)-3-amino-2-hydroxypropyl]piperazin-1-yl]-2-ethylbutan-1-one Traditional Name: 1-[4-[(2R)-3-amino-2-hydroxy-propyl]piperazino]-2-ethyl-butan-1-one Formula: C13H27N3O2 MolecularWeight: 257.37238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)CC(CN)O

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C[C@@H](CN)O

InChI

InChI=1S/C13H27N3O2/c1-3-11(4-2)13(18)16-7-5-15(6-8-16)10-12(17)9-14/h11-12,17H,3-10,14H2,1-2H3/t12-/m1/s1