(1-octoxy-1-oxidanylidene-propan-2-yl) (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoate

Systemtic Name: (1-octoxy-1-oxidanylidene-propan-2-yl) (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoate Openeye Name: (1-methyl-2-octoxy-2-oxo-ethyl) (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoate CAS Name: (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoic acid (1-octoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-octoxy-1-oxopropan-2-yl) (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoate Traditional Name: (2E,4E)-2-cyano-5-(diethylamino)penta-2,4-dienoic acid (2-keto-1-methyl-2-octoxy-ethyl) ester Formula: C21H34N2O4 MolecularWeight: 378.50566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(C)OC(=O)C(=CC=CN(CC)CC)C#N

Isomeric SMILES

CCCCCCCCOC(=O)C(C)OC(=O)/C(=C/C=C/N(CC)CC)/C#N

InChI

InChI=1S/C21H34N2O4/c1-5-8-9-10-11-12-16-26-20(24)18(4)27-21(25)19(17-22)14-13-15-23(6-2)7-3/h13-15,18H,5-12,16H2,1-4H3/b15-13+,19-14+