2-[[4-(dimethylamino)piperidin-1-yl]methyl]furan-3-carboxylic acid

Systemtic Name: 2-[[4-(dimethylamino)piperidin-1-yl]methyl]furan-3-carboxylic acid Openeye Name: 2-[[4-(dimethylamino)-1-piperidyl]methyl]furan-3-carboxylic acid CAS Name: 2-[[4-(dimethylamino)-1-piperidinyl]methyl]-3-furancarboxylic acid IUPAC Name: 2-[[4-(dimethylamino)piperidin-1-yl]methyl]furan-3-carboxylic acid Traditional Name: 2-[[4-(dimethylamino)piperidino]methyl]-3-furoic acid Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)CC2=C(C=CO2)C(=O)O

Isomeric SMILES

CN(C)C1CCN(CC1)CC2=C(C=CO2)C(=O)O

InChI

InChI=1S/C13H20N2O3/c1-14(2)10-3-6-15(7-4-10)9-12-11(13(16)17)5-8-18-12/h5,8,10H,3-4,6-7,9H2,1-2H3,(H,16,17)