N1-ethyl-N4,N4-dimethyl-N1-(2-methylprop-2-enyl)-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1-ethyl-N4,N4-dimethyl-N1-(2-methylprop-2-enyl)-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-ethyl-N4,N4-dimethyl-N1-(2-methylallyl)-2-nitro-benzene-1,4-disulfonamide CAS Name: N1-ethyl-N4,N4-dimethyl-N1-(2-methylprop-2-enyl)-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N-ethyl-4-N,4-N-dimethyl-1-N-(2-methylprop-2-enyl)-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-ethyl-N',N'-dimethyl-N-(2-methylallyl)-2-nitro-benzene-1,4-disulfonamide Formula: C14H21N3O6S2 MolecularWeight: 391.46304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O6S2/c1-6-16(10-11(2)3)25(22,23)14-8-7-12(9-13(14)17(18)19)24(20,21)15(4)5/h7-9H,2,6,10H2,1,3-5H3