N-(2-azanylethyl)-2-chloranyl-4-nitro-benzenesulfonamide

Systemtic Name: N-(2-azanylethyl)-2-chloranyl-4-nitro-benzenesulfonamide Openeye Name: N-(2-aminoethyl)-2-chloro-4-nitro-benzenesulfonamide CAS Name: N-(2-aminoethyl)-2-chloro-4-nitrobenzenesulfonamide IUPAC Name: N-(2-aminoethyl)-2-chloro-4-nitrobenzenesulfonamide Traditional Name: N-(2-aminoethyl)-2-chloro-4-nitro-benzenesulfonamide Formula: C8H10ClN3O4S MolecularWeight: 279.7007

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10ClN3O4S/c9-7-5-6(12(13)14)1-2-8(7)17(15,16)11-4-3-10/h1-2,5,11H,3-4,10H2