(2-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-cyanophenyl) ester Formula: C18H16N2O4S MolecularWeight: 356.39564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C#N

InChI

InChI=1S/C18H16N2O4S/c19-13-15-5-1-2-6-17(15)24-18(21)14-7-9-16(10-8-14)25(22,23)20-11-3-4-12-20/h1-2,5-10H,3-4,11-12H2