4-(2-azanylethylamino)-3-nitro-benzenesulfonic acid

Systemtic Name: 4-(2-azanylethylamino)-3-nitro-benzenesulfonic acid Openeye Name: 4-(2-aminoethylamino)-3-nitro-benzenesulfonic acid CAS Name: 4-(2-aminoethylamino)-3-nitrobenzenesulfonic acid IUPAC Name: 4-(2-aminoethylamino)-3-nitrobenzenesulfonic acid Traditional Name: 4-(2-aminoethylamino)-3-nitro-besylic acid Formula: C8H11N3O5S MolecularWeight: 261.25504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])NCCN

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])NCCN

InChI

InChI=1S/C8H11N3O5S/c9-3-4-10-7-2-1-6(17(14,15)16)5-8(7)11(12)13/h1-2,5,10H,3-4,9H2,(H,14,15,16)