N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]-2-methylpropyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methylpropyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-nitro-benzenesulfonamide Formula: C16H26N3O5S+ MolecularWeight: 372.45974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)C(C)(C)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)C(C)(C)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O5S/c1-12-9-18(10-13(2)24-12)16(3,4)11-17-25(22,23)15-7-5-14(6-8-15)19(20)21/h5-8,12-13,17H,9-11H2,1-4H3/p+1/t12-,13-/m0/s1