4-[(4-dimethylaminophenyl)amino]-3,5-dinitro-benzenesulfonic acid

Systemtic Name: 4-[(4-dimethylaminophenyl)amino]-3,5-dinitro-benzenesulfonic acid Openeye Name: 4-[4-(dimethylamino)anilino]-3,5-dinitro-benzenesulfonic acid CAS Name: 4-[4-(dimethylamino)anilino]-3,5-dinitrobenzenesulfonic acid IUPAC Name: 4-[4-(dimethylamino)anilino]-3,5-dinitrobenzenesulfonic acid Traditional Name: 4-[4-(dimethylamino)anilino]-3,5-dinitro-besylic acid Formula: C14H14N4O7S MolecularWeight: 382.34856

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O7S/c1-16(2)10-5-3-9(4-6-10)15-14-12(17(19)20)7-11(26(23,24)25)8-13(14)18(21)22/h3-8,15H,1-2H3,(H,23,24,25)