3-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(3-methoxypropylamino)-2-oxo-ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-(3-methoxypropylamino)-2-oxoethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-(3-methoxypropylamino)-2-oxoethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-keto-2-(3-methoxypropylamino)ethyl]piperazino]propionic acid Formula: C13H25N3O4 MolecularWeight: 287.3553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CN1CCN(CC1)CCC(=O)O

Isomeric SMILES

COCCCNC(=O)CN1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C13H25N3O4/c1-20-10-2-4-14-12(17)11-16-8-6-15(7-9-16)5-3-13(18)19/h2-11H2,1H3,(H,14,17)(H,18,19)