[azanyl-(3-nitrophenyl)methylidene]-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonyloxy-azanium

Systemtic Name: [azanyl-(3-nitrophenyl)methylidene]-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonyloxy-azanium Openeye Name: [amino-(3-nitrophenyl)methylene]-[(2S)-5-oxo-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]oxy-ammonium CAS Name: [amino-(3-nitrophenyl)methylidene]-[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinyl]-oxomethoxy]ammonium IUPAC Name: [amino-(3-nitrophenyl)methylidene]-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carbonyl]oxyazanium Traditional Name: [amino-(3-nitrophenyl)methylene]-[(2S)-5-keto-1-tosyl-prolyl]oxy-ammonium Formula: C19H19N4O7S+ MolecularWeight: 447.44176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)O[NH+]=C(C3=CC(=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CCC2=O)C(=O)O[NH+]=C(C3=CC(=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C19H18N4O7S/c1-12-5-7-15(8-6-12)31(28,29)22-16(9-10-17(22)24)19(25)30-21-18(20)13-3-2-4-14(11-13)23(26)27/h2-8,11,16H,9-10H2,1H3,(H2,20,21)/p+1/t16-/m0/s1