methyl 2-acetamido-6-[[(E)-3-oxidanylideneprop-1-enyl]amino]hexanoate

Systemtic Name: methyl 2-acetamido-6-[[(E)-3-oxidanylideneprop-1-enyl]amino]hexanoate Openeye Name: methyl 2-acetamido-6-[[(E)-3-oxoprop-1-enyl]amino]hexanoate CAS Name: 2-acetamido-6-[[(E)-3-oxoprop-1-enyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[[(E)-3-oxoprop-1-enyl]amino]hexanoate Traditional Name: 2-acetamido-6-[[(E)-3-ketoprop-1-enyl]amino]hexanoic acid methyl ester Formula: C12H20N2O4 MolecularWeight: 256.2982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCNC=CC=O)C(=O)OC

Isomeric SMILES

CC(=O)NC(CCCCN/C=C/C=O)C(=O)OC

InChI

InChI=1S/C12H20N2O4/c1-10(16)14-11(12(17)18-2)6-3-4-7-13-8-5-9-15/h5,8-9,11,13H,3-4,6-7H2,1-2H3,(H,14,16)/b8-5+