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

Systemtic Name: (3-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (3-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (3-cyanophenyl) ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H16N2O4S/c19-13-14-4-3-5-16(12-14)24-18(21)15-6-8-17(9-7-15)25(22,23)20-10-1-2-11-20/h3-9,12H,1-2,10-11H2