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

Systemtic Name: (2-cyanophenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-cyanophenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-cyanobenzyl) ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C19H18N2O4S/c20-13-16-6-1-2-7-17(16)14-25-19(22)15-8-5-9-18(12-15)26(23,24)21-10-3-4-11-21/h1-2,5-9,12H,3-4,10-11,14H2