ethyl (E)-3-[[4-[(4-tert-butylphenyl)carbonylamino]phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[4-[(4-tert-butylphenyl)carbonylamino]phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(4-tert-butylbenzoyl)amino]anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(4-tert-butylbenzoyl)amino]anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[(4-tert-butylbenzoyl)amino]anilino]-2-cyano-acrylic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)/C#N

InChI

InChI=1S/C23H25N3O3/c1-5-29-22(28)17(14-24)15-25-19-10-12-20(13-11-19)26-21(27)16-6-8-18(9-7-16)23(2,3)4/h6-13,15,25H,5H2,1-4H3,(H,26,27)/b17-15+