4-(furan-2-ylmethylamino)-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-(furan-2-ylmethylamino)-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(2-furylmethylamino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(2-furanylmethylamino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(furan-2-ylmethylamino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(2-furfurylamino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)NCC1=CC=CO1)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)NCC1=CC=CO1)C(=O)O

InChI

InChI=1S/C13H19NO4/c1-9(2)13(3,12(16)17)7-11(15)14-8-10-5-4-6-18-10/h4-6,9H,7-8H2,1-3H3,(H,14,15)(H,16,17)