ethyl (E)-2-cyano-3-[[4-(2-methylpropanoylamino)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[4-(2-methylpropanoylamino)phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-(2-methylpropanoylamino)anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[(2-methyl-1-oxopropyl)amino]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-(2-methylpropanoylamino)anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(isobutyrylamino)anilino]acrylic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3/c1-4-22-16(21)12(9-17)10-18-13-5-7-14(8-6-13)19-15(20)11(2)3/h5-8,10-11,18H,4H2,1-3H3,(H,19,20)/b12-10+