diethyl 2-(3-chloranyl-4-oxidanylidene-2-phenyl-cyclobut-2-en-1-yl)propanedioate

Systemtic Name: diethyl 2-(3-chloranyl-4-oxidanylidene-2-phenyl-cyclobut-2-en-1-yl)propanedioate Openeye Name: diethyl 2-(3-chloro-4-oxo-2-phenyl-cyclobut-2-en-1-yl)propanedioate CAS Name: 2-(3-chloro-4-oxo-2-phenyl-1-cyclobut-2-enyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-chloro-4-oxo-2-phenylcyclobut-2-en-1-yl)propanedioate Traditional Name: 2-(3-chloro-4-keto-2-phenyl-cyclobut-2-en-1-yl)malonic acid diethyl ester Formula: C17H17ClO5 MolecularWeight: 336.76688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C(=C(C1=O)Cl)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1C(=C(C1=O)Cl)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C17H17ClO5/c1-3-22-16(20)13(17(21)23-4-2)12-11(14(18)15(12)19)10-8-6-5-7-9-10/h5-9,12-13H,3-4H2,1-2H3