2-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-4,6-dinitro-phenolate Openeye Name: 2-[(Z)-(1,3-benzothiazol-2-ylhydrazono)methyl]-4,6-dinitro-phenolate CAS Name: 2-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-4,6-dinitrophenolate IUPAC Name: 2-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-4,6-dinitrophenolate Traditional Name: 2-[(Z)-(1,3-benzothiazol-2-ylhydrazono)methyl]-4,6-dinitro-phenolate Formula: C14H8N5O5S- MolecularWeight: 358.30882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NN=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N/N=C\C3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5S/c20-13-8(5-9(18(21)22)6-11(13)19(23)24)7-15-17-14-16-10-3-1-2-4-12(10)25-14/h1-7,20H,(H,16,17)/p-1/b15-7-