(E)-4-oxidanylidene-4-[[2-oxidanylidene-2-(propylamino)ethyl]amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[2-oxidanylidene-2-(propylamino)ethyl]amino]but-2-enoic acid Openeye Name: (E)-4-oxo-4-[[2-oxo-2-(propylamino)ethyl]amino]but-2-enoic acid CAS Name: (E)-4-oxo-4-[[2-oxo-2-(propylamino)ethyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[[2-oxo-2-(propylamino)ethyl]amino]but-2-enoic acid Traditional Name: (E)-4-keto-4-[[2-keto-2-(propylamino)ethyl]amino]but-2-enoic acid Formula: C9H14N2O4 MolecularWeight: 214.21846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C=CC(=O)O

Isomeric SMILES

CCCNC(=O)CNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H14N2O4/c1-2-5-10-8(13)6-11-7(12)3-4-9(14)15/h3-4H,2,5-6H2,1H3,(H,10,13)(H,11,12)(H,14,15)/b4-3+