2-[4-(3-methylfuran-2-yl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-methylfuran-2-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-methylfuran-2-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(3-methyl-2-furanyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-methylfuran-2-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-methyl-2-furoyl)piperazino]acetic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC=C1)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=C(OC=C1)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C12H16N2O4/c1-9-2-7-18-11(9)12(17)14-5-3-13(4-6-14)8-10(15)16/h2,7H,3-6,8H2,1H3,(H,15,16)