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

Systemtic Name: 4-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-ethoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-ethoxy-6-nitro-phenolate CAS Name: 4-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-ethoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-ethoxy-6-nitrophenolate Traditional Name: 4-[(Z)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-ethoxy-6-nitro-phenolate Formula: C16H13N4O4S- MolecularWeight: 357.36382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=NNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=N\NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H14N4O4S/c1-2-24-13-8-10(7-12(15(13)21)20(22)23)9-17-19-16-18-11-5-3-4-6-14(11)25-16/h3-9,21H,2H2,1H3,(H,18,19)/p-1/b17-9-