2-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(2-furylmethylamino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C12H18N2O4 MolecularWeight: 254.28232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4/c1-8(2)11(12(16)17)14-7-10(15)13-6-9-4-3-5-18-9/h3-5,8,11,14H,6-7H2,1-2H3,(H,13,15)(H,16,17)