(2-chlorophenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chlorophenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-chlorophenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-chlorobenzyl) ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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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=C3Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C18H18ClNO4S/c19-17-6-2-1-5-15(17)13-24-18(21)14-7-9-16(10-8-14)25(22,23)20-11-3-4-12-20/h1-2,5-10H,3-4,11-13H2