ethyl 2-cyano-3-[2-[(4-iodophenyl)methylsulfamoyl]phenyl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-cyano-3-[2-[(4-iodophenyl)methylsulfamoyl]phenyl]-3-oxidanylidene-propanoate Openeye Name: ethyl 2-cyano-3-[2-[(4-iodophenyl)methylsulfamoyl]phenyl]-3-oxo-propanoate CAS Name: 2-cyano-3-[2-[(4-iodophenyl)methylsulfamoyl]phenyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[2-[(4-iodophenyl)methylsulfamoyl]phenyl]-3-oxopropanoate Traditional Name: 2-cyano-3-[2-[(4-iodobenzyl)sulfamoyl]phenyl]-3-keto-propionic acid ethyl ester Formula: C19H17IN2O5S MolecularWeight: 512.31815

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)I

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)I

InChI

InChI=1S/C19H17IN2O5S/c1-2-27-19(24)16(11-21)18(23)15-5-3-4-6-17(15)28(25,26)22-12-13-7-9-14(20)10-8-13/h3-10,16,22H,2,12H2,1H3