(3-cyanophenyl)methyl 1-(4-chlorophenyl)sulfonylcyclopentane-1-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 1-(4-chlorophenyl)sulfonylcyclopentane-1-carboxylate Openeye Name: (3-cyanophenyl)methyl 1-(4-chlorophenyl)sulfonylcyclopentanecarboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-1-cyclopentanecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 1-(4-chlorophenyl)sulfonylcyclopentane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylcyclopentanecarboxylic acid (3-cyanobenzyl) ester Formula: C20H18ClNO4S MolecularWeight: 403.87922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)OCC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(C1)(C(=O)OCC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO4S/c21-17-6-8-18(9-7-17)27(24,25)20(10-1-2-11-20)19(23)26-14-16-5-3-4-15(12-16)13-22/h3-9,12H,1-2,10-11,14H2