ethyl N-[(2E)-2-[[(5-iodanylpyridin-2-yl)amino]methylidene]-3-oxidanylidene-butanoyl]carbamate

Systemtic Name: ethyl N-[(2E)-2-[[(5-iodanylpyridin-2-yl)amino]methylidene]-3-oxidanylidene-butanoyl]carbamate Openeye Name: ethyl N-[(2E)-2-[[(5-iodo-2-pyridyl)amino]methylene]-3-oxo-butanoyl]carbamate CAS Name: N-[(2E)-2-[[(5-iodo-2-pyridinyl)amino]methylidene]-1,3-dioxobutyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(2E)-2-[[(5-iodopyridin-2-yl)amino]methylidene]-3-oxobutanoyl]carbamate Traditional Name: N-[(E)-2-acetyl-3-[(5-iodo-2-pyridyl)amino]acryloyl]carbamic acid ethyl ester Formula: C13H14IN3O4 MolecularWeight: 403.17243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C(=CNC1=NC=C(C=C1)I)C(=O)C

Isomeric SMILES

CCOC(=O)NC(=O)/C(=C/NC1=NC=C(C=C1)I)/C(=O)C

InChI

InChI=1S/C13H14IN3O4/c1-3-21-13(20)17-12(19)10(8(2)18)7-16-11-5-4-9(14)6-15-11/h4-7H,3H2,1-2H3,(H,15,16)(H,17,19,20)/b10-7+