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

Systemtic Name: 2-[[butan-2-yl(ethyl)amino]methyl]furan-3-carboxylic acid Openeye Name: 2-[[ethyl(sec-butyl)amino]methyl]furan-3-carboxylic acid CAS Name: 2-[[butan-2-yl(ethyl)amino]methyl]-3-furancarboxylic acid IUPAC Name: 2-[[butan-2-yl(ethyl)amino]methyl]furan-3-carboxylic acid Traditional Name: 2-[[ethyl(sec-butyl)amino]methyl]-3-furoic acid Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)CC1=C(C=CO1)C(=O)O

Isomeric SMILES

CCC(C)N(CC)CC1=C(C=CO1)C(=O)O

InChI

InChI=1S/C12H19NO3/c1-4-9(3)13(5-2)8-11-10(12(14)15)6-7-16-11/h6-7,9H,4-5,8H2,1-3H3,(H,14,15)