3-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[3-(3-methylphenoxy)-1-oxopropyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[3-(3-methylphenoxy)propanoyl]piperazino]propionic acid Formula: C17H24N2O4 MolecularWeight: 320.38346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C17H24N2O4/c1-14-3-2-4-15(13-14)23-12-6-16(20)19-10-8-18(9-11-19)7-5-17(21)22/h2-4,13H,5-12H2,1H3,(H,21,22)