ethyl 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-oxo-propanoate CAS Name: 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-oxopropanoate Traditional Name: 3-[2-[4-(4-chlorophenyl)butylsulfamoyl]phenyl]-2-cyano-3-keto-propionic acid ethyl ester Formula: C22H23ClN2O5S MolecularWeight: 462.94642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCCCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCCCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H23ClN2O5S/c1-2-30-22(27)19(15-24)21(26)18-8-3-4-9-20(18)31(28,29)25-14-6-5-7-16-10-12-17(23)13-11-16/h3-4,8-13,19,25H,2,5-7,14H2,1H3