2-(3-bromanylphenoxy)ethyl 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate Openeye Name: 2-(3-bromophenoxy)ethyl 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C21H22BrNO4S MolecularWeight: 464.37268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)OCCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)OCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H22BrNO4S/c22-16-6-5-7-17(14-16)26-12-13-27-21(25)18-8-1-2-9-19(18)28-15-20(24)23-10-3-4-11-23/h1-2,5-9,14H,3-4,10-13,15H2