pyridin-2-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: pyridin-2-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: 2-pyridylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid 2-pyridylmethyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C17H18N2O4S/c20-17(23-13-15-5-1-2-10-18-15)14-6-8-16(9-7-14)24(21,22)19-11-3-4-12-19/h1-2,5-10H,3-4,11-13H2