3-chloranyl-N,4-dimethyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N,4-dimethyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N,4-dimethyl-N-(2-morpholino-2-oxo-ethyl)-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N,4-dimethyl-N-[2-(4-morpholinyl)-2-oxoethyl]-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N,4-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-(2-keto-2-morpholino-ethyl)-N,4-dimethyl-5-nitro-benzenesulfonamide Formula: C14H18ClN3O6S MolecularWeight: 391.82722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N(C)CC(=O)N2CCOCC2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N(C)CC(=O)N2CCOCC2)Cl

InChI

InChI=1S/C14H18ClN3O6S/c1-10-12(15)7-11(8-13(10)18(20)21)25(22,23)16(2)9-14(19)17-3-5-24-6-4-17/h7-8H,3-6,9H2,1-2H3