5-[[bis(2-methylpropyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[bis(2-methylpropyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[(diisobutylamino)methyl]furan-2-carboxylic acid CAS Name: 5-[[bis(2-methylpropyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[bis(2-methylpropyl)amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[(diisobutylamino)methyl]-2-furoic acid Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(O1)C(=O)O)CC(C)C

Isomeric SMILES

CC(C)CN(CC1=CC=C(O1)C(=O)O)CC(C)C

InChI

InChI=1S/C14H23NO3/c1-10(2)7-15(8-11(3)4)9-12-5-6-13(18-12)14(16)17/h5-6,10-11H,7-9H2,1-4H3,(H,16,17)