(2S)-2-azanyl-4-methyl-1-(4-prop-2-enylpiperazin-1-yl)pentan-1-one

Systemtic Name: (2S)-2-azanyl-4-methyl-1-(4-prop-2-enylpiperazin-1-yl)pentan-1-one Openeye Name: (2S)-1-(4-allylpiperazin-1-yl)-2-amino-4-methyl-pentan-1-one CAS Name: (2S)-2-amino-4-methyl-1-(4-prop-2-enyl-1-piperazinyl)-1-pentanone IUPAC Name: (2S)-2-amino-4-methyl-1-(4-prop-2-enylpiperazin-1-yl)pentan-1-one Traditional Name: (2S)-1-(4-allylpiperazino)-2-amino-4-methyl-pentan-1-one Formula: C13H25N3O MolecularWeight: 239.3571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)CC=C)N

Isomeric SMILES

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

InChI

InChI=1S/C13H25N3O/c1-4-5-15-6-8-16(9-7-15)13(17)12(14)10-11(2)3/h4,11-12H,1,5-10,14H2,2-3H3/t12-/m0/s1