2-[3-(furan-2-yl)propanoylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[3-(furan-2-yl)propanoylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[3-(2-furyl)propanoylamino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[3-(2-furanyl)-1-oxopropyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[3-(furan-2-yl)propanoylamino]-3,3-dimethylbutanoic acid Traditional Name: 2-[3-(2-furyl)propanoylamino]-3,3-dimethyl-butyric acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)CCC1=CC=CO1

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)CCC1=CC=CO1

InChI

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