ethyl (E)-3-[(4-benzamido-2,5-dimethoxy-phenyl)amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[(4-benzamido-2,5-dimethoxy-phenyl)amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-(4-benzamido-2,5-dimethoxy-anilino)-2-cyano-prop-2-enoate CAS Name: (E)-3-(4-benzamido-2,5-dimethoxyanilino)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-benzamido-2,5-dimethoxyanilino)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-benzamido-2,5-dimethoxy-anilino)-2-cyano-acrylic acid ethyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)OC)/C#N

InChI

InChI=1S/C21H21N3O5/c1-4-29-21(26)15(12-22)13-23-16-10-19(28-3)17(11-18(16)27-2)24-20(25)14-8-6-5-7-9-14/h5-11,13,23H,4H2,1-3H3,(H,24,25)/b15-13+