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

Systemtic Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[2-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]-2-methylpropyl]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methylpropyl]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C20H33N4O6S+ MolecularWeight: 457.56422

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O6S/c1-15-12-22(13-16(2)30-15)20(3,4)14-21-18-6-5-17(11-19(18)24(25)26)31(27,28)23-7-9-29-10-8-23/h5-6,11,15-16,21H,7-10,12-14H2,1-4H3/p+1/t15-,16-/m0/s1