diethyl 2-[(Z)-2-bromanyl-3-phenyl-prop-2-enyl]-2-(cyanomethyl)propanedioate

Systemtic Name: diethyl 2-[(Z)-2-bromanyl-3-phenyl-prop-2-enyl]-2-(cyanomethyl)propanedioate Openeye Name: diethyl 2-[(Z)-2-bromo-3-phenyl-allyl]-2-(cyanomethyl)propanedioate CAS Name: 2-[(Z)-2-bromo-3-phenylprop-2-enyl]-2-(cyanomethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(Z)-2-bromo-3-phenylprop-2-enyl]-2-(cyanomethyl)propanedioate Traditional Name: 2-[(Z)-2-bromo-3-phenyl-allyl]-2-(cyanomethyl)malonic acid diethyl ester Formula: C18H20BrNO4 MolecularWeight: 394.2597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#N)(CC(=CC1=CC=CC=C1)Br)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrNO4/c1-3-23-16(21)18(10-11-20,17(22)24-4-2)13-15(19)12-14-8-6-5-7-9-14/h5-9,12H,3-4,10,13H2,1-2H3/b15-12-