4-[2-[(2,4-dinitrophenyl)amino]ethylamino]phenol sulfate

Systemtic Name: 4-[2-[(2,4-dinitrophenyl)amino]ethylamino]phenol sulfate Openeye Name: 4-[2-(2,4-dinitroanilino)ethylamino]phenol sulfate CAS Name: 4-[2-(2,4-dinitroanilino)ethylamino]phenol sulfate IUPAC Name: 4-[2-(2,4-dinitroanilino)ethylamino]phenol sulfate Traditional Name: 4-[2-(2,4-dinitroanilino)ethylamino]phenol sulfate Formula: C14H14N4O9S-2 MolecularWeight: 414.34736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C14H14N4O5.H2O4S/c19-12-4-1-10(2-5-12)15-7-8-16-13-6-3-11(17(20)21)9-14(13)18(22)23;1-5(2,3)4/h1-6,9,15-16,19H,7-8H2;(H2,1,2,3,4)/p-2