4-[[4,6-bis(chloranyl)pyrimidin-5-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4,6-bis(chloranyl)pyrimidin-5-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(4,6-dichloropyrimidin-5-yl)amino]-4-oxo-butanoate CAS Name: 4-[(4,6-dichloro-5-pyrimidinyl)amino]-4-oxobutanoate IUPAC Name: 4-[(4,6-dichloropyrimidin-5-yl)amino]-4-oxobutanoate Traditional Name: 4-[(4,6-dichloropyrimidin-5-yl)amino]-4-keto-butyrate Formula: C8H6Cl2N3O3- MolecularWeight: 263.05754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(C(=N1)Cl)NC(=O)CCC(=O)[O-])Cl

Isomeric SMILES

C1=NC(=C(C(=N1)Cl)NC(=O)CCC(=O)[O-])Cl

InChI

InChI=1S/C8H7Cl2N3O3/c9-7-6(8(10)12-3-11-7)13-4(14)1-2-5(15)16/h3H,1-2H2,(H,13,14)(H,15,16)/p-1