ethyl 2-acetamido-2-cyano-3-[4-(2-hydroxyphenyl)carbonylphenyl]propanoate

Systemtic Name: ethyl 2-acetamido-2-cyano-3-[4-(2-hydroxyphenyl)carbonylphenyl]propanoate Openeye Name: ethyl 2-acetamido-2-cyano-3-[4-(2-hydroxybenzoyl)phenyl]propanoate CAS Name: 2-acetamido-2-cyano-3-[4-[(2-hydroxyphenyl)-oxomethyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-2-cyano-3-[4-(2-hydroxybenzoyl)phenyl]propanoate Traditional Name: 2-acetamido-2-cyano-3-(4-salicyloylphenyl)propionic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2O)(C#N)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2O)(C#N)NC(=O)C

InChI

InChI=1S/C21H20N2O5/c1-3-28-20(27)21(13-22,23-14(2)24)12-15-8-10-16(11-9-15)19(26)17-6-4-5-7-18(17)25/h4-11,25H,3,12H2,1-2H3,(H,23,24)