[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-cyanobenzoate

Systemtic Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-cyanobenzoate Openeye Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H15ClN2O4S MolecularWeight: 426.8728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H15ClN2O4S/c1-24(29(26,27)20-11-5-17(22)6-12-20)18-7-9-19(10-8-18)28-21(25)16-4-2-3-15(13-16)14-23/h2-13H,1H3