methyl 2-methyl-5-[[2-(2-methylpropanoylamino)ethylamino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[2-(2-methylpropanoylamino)ethylamino]methyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[2-(2-methylpropanoylamino)ethylamino]methyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[2-[(2-methyl-1-oxopropyl)amino]ethylamino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[2-(2-methylpropanoylamino)ethylamino]methyl]furan-3-carboxylate Traditional Name: 5-[[2-(isobutyrylamino)ethylamino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CNCCNC(=O)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CNCCNC(=O)C(C)C)C(=O)OC

InChI

InChI=1S/C14H22N2O4/c1-9(2)13(17)16-6-5-15-8-11-7-12(10(3)20-11)14(18)19-4/h7,9,15H,5-6,8H2,1-4H3,(H,16,17)