3-cyanopropyl 2-chloranyl-5-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: 3-cyanopropyl 2-chloranyl-5-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: 3-cyanopropyl 5-[allyl-(4-chlorophenyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-chloro-5-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 5-[allyl-(4-chlorophenyl)sulfamoyl]-2-chloro-benzoic acid 3-cyanopropyl ester Formula: C20H18Cl2N2O4S MolecularWeight: 453.33892

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCCC#N

Isomeric SMILES

C=CCN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCCC#N

InChI

InChI=1S/C20H18Cl2N2O4S/c1-2-12-24(16-7-5-15(21)6-8-16)29(26,27)17-9-10-19(22)18(14-17)20(25)28-13-4-3-11-23/h2,5-10,14H,1,3-4,12-13H2