2-[(4-methylphenyl)sulfonylamino]ethyl-[(5-nitrofuran-2-yl)methylidene]azanium

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]ethyl-[(5-nitrofuran-2-yl)methylidene]azanium Openeye Name: (5-nitro-2-furyl)methylene-[2-(p-tolylsulfonylamino)ethyl]ammonium CAS Name: 2-[(4-methylphenyl)sulfonylamino]ethyl-[(5-nitro-2-furanyl)methylidene]ammonium IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]ethyl-[(5-nitrofuran-2-yl)methylidene]azanium Traditional Name: (5-nitro-2-furyl)methylene-[2-(tosylamino)ethyl]ammonium Formula: C14H16N3O5S+ MolecularWeight: 338.35894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]=CC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O5S/c1-11-2-5-13(6-3-11)23(20,21)16-9-8-15-10-12-4-7-14(22-12)17(18)19/h2-7,10,16H,8-9H2,1H3/p+1