2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide

Systemtic Name: 2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide Openeye Name: 2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide CAS Name: 2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide IUPAC Name: 2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide Traditional Name: 2-[1-(3-nitrophenyl)butylamino]ethanesulfonamide Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCCS(=O)(=O)N

Isomeric SMILES

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCCS(=O)(=O)N

InChI

InChI=1S/C12H19N3O4S/c1-2-4-12(14-7-8-20(13,18)19)10-5-3-6-11(9-10)15(16)17/h3,5-6,9,12,14H,2,4,7-8H2,1H3,(H2,13,18,19)