3-[4-[(5-methylfuran-2-yl)methyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(5-methylfuran-2-yl)methyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[(5-methyl-2-furyl)methyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(5-methyl-2-furanyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(5-methylfuran-2-yl)methyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[(5-methyl-2-furyl)methyl]piperazino]propionic acid Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC1=CC=C(O1)CN2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C13H20N2O3/c1-11-2-3-12(18-11)10-15-8-6-14(7-9-15)5-4-13(16)17/h2-3H,4-10H2,1H3,(H,16,17)