2-(3-bromanylphenoxy)ethyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: 2-(3-bromophenoxy)ethyl 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C19H19BrClNO5S MolecularWeight: 488.77986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCOC3=CC(=CC=C3)Br)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCOC3=CC(=CC=C3)Br)Cl

InChI

InChI=1S/C19H19BrClNO5S/c20-15-4-3-5-16(13-15)26-10-11-27-19(23)14-6-7-17(21)18(12-14)28(24,25)22-8-1-2-9-22/h3-7,12-13H,1-2,8-11H2