5-[(4-ethanoylpiperazin-1-yl)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(4-ethanoylpiperazin-1-yl)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(4-acetylpiperazin-1-yl)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(4-acetyl-1-piperazinyl)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(4-acetylpiperazin-1-yl)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(4-acetylpiperazino)methyl]-2-methyl-3-furoic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-9-12(13(17)18)7-11(19-9)8-14-3-5-15(6-4-14)10(2)16/h7H,3-6,8H2,1-2H3,(H,17,18)