3-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(3,5-dimethylisoxazol-4-yl)acetyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-(3,5-dimethyl-4-isoxazolyl)-1-oxoethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(3,5-dimethylisoxazol-4-yl)acetyl]piperazino]propionic acid Formula: C14H21N3O4 MolecularWeight: 295.33424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC(=O)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CC(=O)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C14H21N3O4/c1-10-12(11(2)21-15-10)9-13(18)17-7-5-16(6-8-17)4-3-14(19)20/h3-9H2,1-2H3,(H,19,20)