2-[(Z)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]-6-ethoxy-4-nitro-phenolate

Systemtic Name: 2-[(Z)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]-6-ethoxy-4-nitro-phenolate Openeye Name: 2-[(Z)-(1,3-benzodioxole-5-carbonylhydrazono)methyl]-6-ethoxy-4-nitro-phenolate CAS Name: 2-[(Z)-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]-6-ethoxy-4-nitrophenolate IUPAC Name: 2-[(Z)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-6-ethoxy-4-nitrophenolate Traditional Name: 2-ethoxy-4-nitro-6-[(Z)-(piperonyloylhydrazono)methyl]phenolate Formula: C17H14N3O7- MolecularWeight: 372.30896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NNC(=O)C2=CC3=C(C=C2)OCO3)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])/C=N\NC(=O)C2=CC3=C(C=C2)OCO3)[O-]

InChI

InChI=1S/C17H15N3O7/c1-2-25-15-7-12(20(23)24)5-11(16(15)21)8-18-19-17(22)10-3-4-13-14(6-10)27-9-26-13/h3-8,21H,2,9H2,1H3,(H,19,22)/p-1/b18-8-