[2-(methylamino)-2-oxidanylidene-ethyl] 2-bromanyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 2-bromanyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 2-bromo-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-bromo-5-(1-pyrrolidinylsulfonyl)benzoic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 2-bromo-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-bromo-5-pyrrolidinosulfonyl-benzoic acid [2-keto-2-(methylamino)ethyl] ester Formula: C14H17BrN2O5S MolecularWeight: 405.26418

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br

Isomeric SMILES

CNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br

InChI

InChI=1S/C14H17BrN2O5S/c1-16-13(18)9-22-14(19)11-8-10(4-5-12(11)15)23(20,21)17-6-2-3-7-17/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,18)