(4-bromophenyl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-bromophenyl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (4-bromophenyl) 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid (4-bromophenyl) ester Formula: C17H15BrClNO4S MolecularWeight: 444.7273

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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