2-[1-(4-methyl-3-nitro-phenyl)ethylamino]ethanesulfonamide

Systemtic Name: 2-[1-(4-methyl-3-nitro-phenyl)ethylamino]ethanesulfonamide Openeye Name: 2-[1-(4-methyl-3-nitro-phenyl)ethylamino]ethanesulfonamide CAS Name: 2-[1-(4-methyl-3-nitrophenyl)ethylamino]ethanesulfonamide IUPAC Name: 2-[1-(4-methyl-3-nitrophenyl)ethylamino]ethanesulfonamide Traditional Name: 2-[1-(4-methyl-3-nitro-phenyl)ethylamino]ethanesulfonamide Formula: C11H17N3O4S MolecularWeight: 287.33538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)NCCS(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)NCCS(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H17N3O4S/c1-8-3-4-10(7-11(8)14(15)16)9(2)13-5-6-19(12,17)18/h3-4,7,9,13H,5-6H2,1-2H3,(H2,12,17,18)