4-[2-morpholin-4-ium-4-yl-3-(4-nitrophenyl)sulfonyl-propyl]morpholin-4-ium

Systemtic Name: 4-[2-morpholin-4-ium-4-yl-3-(4-nitrophenyl)sulfonyl-propyl]morpholin-4-ium Openeye Name: 4-[2-morpholin-4-ium-4-yl-3-(4-nitrophenyl)sulfonyl-propyl]morpholin-4-ium CAS Name: 4-[2-(4-morpholin-4-iumyl)-3-(4-nitrophenyl)sulfonylpropyl]morpholin-4-ium IUPAC Name: 4-[2-morpholin-4-ium-4-yl-3-(4-nitrophenyl)sulfonylpropyl]morpholin-4-ium Traditional Name: 4-(2-morpholin-4-ium-4-yl-3-nosyl-propyl)morpholin-4-ium Formula: C17H27N3O6S+2 MolecularWeight: 401.47778

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCOCC3

Isomeric SMILES

C1COCC[NH+]1CC(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCOCC3

InChI

InChI=1S/C17H25N3O6S/c21-20(22)15-1-3-17(4-2-15)27(23,24)14-16(19-7-11-26-12-8-19)13-18-5-9-25-10-6-18/h1-4,16H,5-14H2/p+2