2-[3-chloranyl-4-(diethylamino)-2,5-bis(oxidanylidene)pyrrol-1-yl]ethanoate

Systemtic Name: 2-[3-chloranyl-4-(diethylamino)-2,5-bis(oxidanylidene)pyrrol-1-yl]ethanoate Openeye Name: 2-[3-chloro-4-(diethylamino)-2,5-dioxo-pyrrol-1-yl]acetate CAS Name: 2-[3-chloro-4-(diethylamino)-2,5-dioxo-1-pyrrolyl]acetate IUPAC Name: 2-[3-chloro-4-(diethylamino)-2,5-dioxopyrrol-1-yl]acetate Traditional Name: 2-[3-chloro-4-(diethylamino)-2,5-diketo-3-pyrrolin-1-yl]acetate Formula: C10H12ClN2O4- MolecularWeight: 259.66628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=O)N(C1=O)CC(=O)[O-])Cl

Isomeric SMILES

CCN(CC)C1=C(C(=O)N(C1=O)CC(=O)[O-])Cl

InChI

InChI=1S/C10H13ClN2O4/c1-3-12(4-2)8-7(11)9(16)13(10(8)17)5-6(14)15/h3-5H2,1-2H3,(H,14,15)/p-1