3-[4-[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(allylamino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[1-oxo-1-(prop-2-enylamino)propan-2-yl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[1-oxo-1-(prop-2-enylamino)propan-2-yl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(allylamino)-2-keto-1-methyl-ethyl]piperazino]propionic acid Formula: C13H23N3O3 MolecularWeight: 269.34002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O3/c1-3-5-14-13(19)11(2)16-9-7-15(8-10-16)6-4-12(17)18/h3,11H,1,4-10H2,2H3,(H,14,19)(H,17,18)