(6-bromanylnaphthalen-2-yl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (6-bromo-2-naphthyl) 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid (6-bromo-2-naphthyl) ester Formula: C21H17BrClNO4S MolecularWeight: 494.78598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br)Cl

InChI

InChI=1S/C21H17BrClNO4S/c22-17-6-3-15-12-18(7-4-14(15)11-17)28-21(25)16-5-8-19(23)20(13-16)29(26,27)24-9-1-2-10-24/h3-8,11-13H,1-2,9-10H2