2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl-[(3-nitrophenyl)methylidene]azanium

Systemtic Name: 2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl-[(3-nitrophenyl)methylidene]azanium Openeye Name: 2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl-[(3-nitrophenyl)methylene]ammonium CAS Name: 2-[(4-methyl-3-nitrophenyl)sulfonylamino]ethyl-[(3-nitrophenyl)methylidene]ammonium IUPAC Name: 2-[(4-methyl-3-nitrophenyl)sulfonylamino]ethyl-[(3-nitrophenyl)methylidene]azanium Traditional Name: 2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl-(3-nitrobenzylidene)ammonium Formula: C16H17N4O6S+ MolecularWeight: 393.39438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC[NH+]=CC2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC[NH+]=CC2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O6S/c1-12-5-6-15(10-16(12)20(23)24)27(25,26)18-8-7-17-11-13-3-2-4-14(9-13)19(21)22/h2-6,9-11,18H,7-8H2,1H3/p+1