(4-bromanyl-2-chloranyl-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (4-bromo-2-chloro-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (4-bromo-2-chloro-phenyl) ester Formula: C17H15BrClNO4S MolecularWeight: 444.7273

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C17H15BrClNO4S/c18-13-6-7-16(15(19)11-13)24-17(21)12-4-3-5-14(10-12)25(22,23)20-8-1-2-9-20/h3-7,10-11H,1-2,8-9H2