(2-cyanophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-cyanophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-cyanophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-cyanophenyl) ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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