[4-[(2,4-dinitrophenyl)amino]phenyl] benzenesulfonate

Systemtic Name: [4-[(2,4-dinitrophenyl)amino]phenyl] benzenesulfonate Openeye Name: [4-(2,4-dinitroanilino)phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-(2,4-dinitroanilino)phenyl] ester IUPAC Name: [4-(2,4-dinitroanilino)phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-(2,4-dinitroanilino)phenyl] ester Formula: C18H13N3O7S MolecularWeight: 415.37672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O7S/c22-20(23)14-8-11-17(18(12-14)21(24)25)19-13-6-9-15(10-7-13)28-29(26,27)16-4-2-1-3-5-16/h1-12,19H