4-chloranyl-N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-methyl-N-(2-morpholino-2-oxo-ethyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-methyl-N-[2-(4-morpholinyl)-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2-keto-2-morpholino-ethyl)-N-methyl-3-nitro-benzenesulfonamide Formula: C13H16ClN3O6S MolecularWeight: 377.80064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCOCC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)N1CCOCC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H16ClN3O6S/c1-15(9-13(18)16-4-6-23-7-5-16)24(21,22)10-2-3-11(14)12(8-10)17(19)20/h2-3,8H,4-7,9H2,1H3