4-[(4-ethylpiperazin-1-yl)methyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[(4-ethylpiperazin-1-yl)methyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[(4-ethylpiperazin-1-yl)methyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[(4-ethyl-1-piperazinyl)methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[(4-ethylpiperazin-1-yl)methyl]-5-methylfuran-2-carboxylic acid Traditional Name: 4-[(4-ethylpiperazino)methyl]-5-methyl-2-furoic acid Formula: C13H20N2O3 MolecularWeight: 252.3095

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(OC(=C2)C(=O)O)C

Isomeric SMILES

CCN1CCN(CC1)CC2=C(OC(=C2)C(=O)O)C

InChI

InChI=1S/C13H20N2O3/c1-3-14-4-6-15(7-5-14)9-11-8-12(13(16)17)18-10(11)2/h8H,3-7,9H2,1-2H3,(H,16,17)