triethyl 2-cyano-3-[(E)-3-oxidanylideneprop-1-enyl]cyclopropane-1,1,2-tricarboxylate

Systemtic Name: triethyl 2-cyano-3-[(E)-3-oxidanylideneprop-1-enyl]cyclopropane-1,1,2-tricarboxylate Openeye Name: triethyl 2-cyano-3-[(E)-3-oxoprop-1-enyl]cyclopropane-1,1,2-tricarboxylate CAS Name: 2-cyano-3-[(E)-3-oxoprop-1-enyl]cyclopropane-1,1,2-tricarboxylic acid triethyl ester IUPAC Name: triethyl 2-cyano-3-[(E)-3-oxoprop-1-enyl]cyclopropane-1,1,2-tricarboxylate Traditional Name: 2-cyano-3-[(E)-3-ketoprop-1-enyl]cyclopropane-1,1,2-tricarboxylic acid triethyl ester Formula: C16H19NO7 MolecularWeight: 337.32456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C1(C(=O)OCC)C(=O)OCC)C=CC=O)C#N

Isomeric SMILES

CCOC(=O)C1(C(C1(C(=O)OCC)C(=O)OCC)/C=C/C=O)C#N

InChI

InChI=1S/C16H19NO7/c1-4-22-12(19)15(10-17)11(8-7-9-18)16(15,13(20)23-5-2)14(21)24-6-3/h7-9,11H,4-6H2,1-3H3/b8-7+