ethyl (E)-2-cyano-3-[[3-(2-methylpropoxy)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[3-(2-methylpropoxy)phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(3-isobutoxyanilino)prop-2-enoate CAS Name: (E)-2-cyano-3-[3-(2-methylpropoxy)anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[3-(2-methylpropoxy)anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-(3-isobutoxyanilino)acrylic acid ethyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=CC=C1)OCC(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC(=CC=C1)OCC(C)C)/C#N

InChI

InChI=1S/C16H20N2O3/c1-4-20-16(19)13(9-17)10-18-14-6-5-7-15(8-14)21-11-12(2)3/h5-8,10,12,18H,4,11H2,1-3H3/b13-10+