[5-(dicyanomethylidene)-7-methoxy-3-propan-2-yl-cyclohepta-1,3,6-trien-1-yl] ethanoate

Systemtic Name: [5-(dicyanomethylidene)-7-methoxy-3-propan-2-yl-cyclohepta-1,3,6-trien-1-yl] ethanoate Openeye Name: [5-(dicyanomethylene)-3-isopropyl-7-methoxy-cyclohepta-1,3,6-trien-1-yl] acetate CAS Name: acetic acid [5-(dicyanomethylidene)-7-methoxy-3-propan-2-yl-1-cyclohepta-1,3,6-trienyl] ester IUPAC Name: [5-(dicyanomethylidene)-7-methoxy-3-propan-2-ylcyclohepta-1,3,6-trien-1-yl] acetate Traditional Name: acetic acid [5-(dicyanomethylene)-3-isopropyl-7-methoxy-cyclohepta-1,3,6-trien-1-yl] ester Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C#N)C#N)C=C(C(=C1)OC(=O)C)OC

Isomeric SMILES

CC(C)C1=CC(=C(C#N)C#N)C=C(C(=C1)OC(=O)C)OC

InChI

InChI=1S/C16H16N2O3/c1-10(2)12-5-13(14(8-17)9-18)7-15(20-4)16(6-12)21-11(3)19/h5-7,10H,1-4H3