2-chloranyl-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-[(2R)-2-(dimethylamino)-2-(2-furyl)ethyl]-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-[(2R)-2-(dimethylamino)-2-(2-furanyl)ethyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-[(2R)-2-(dimethylamino)-2-(2-furyl)ethyl]-5-nitro-benzenesulfonamide Formula: C14H16ClN3O5S MolecularWeight: 373.81194

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CO2

Isomeric SMILES

CN(C)[C@H](CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CO2

InChI

InChI=1S/C14H16ClN3O5S/c1-17(2)12(13-4-3-7-23-13)9-16-24(21,22)14-8-10(18(19)20)5-6-11(14)15/h3-8,12,16H,9H2,1-2H3/t12-/m1/s1