5-[[butan-2-yl(ethyl)amino]methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[[butan-2-yl(ethyl)amino]methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[[ethyl(sec-butyl)amino]methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[butan-2-yl(ethyl)amino]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[[butan-2-yl(ethyl)amino]methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[ethyl(sec-butyl)amino]methyl]-2-methyl-3-furoic acid Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)CC1=CC(=C(O1)C)C(=O)O

Isomeric SMILES

CCC(C)N(CC)CC1=CC(=C(O1)C)C(=O)O

InChI

InChI=1S/C13H21NO3/c1-5-9(3)14(6-2)8-11-7-12(13(15)16)10(4)17-11/h7,9H,5-6,8H2,1-4H3,(H,15,16)