2-(1,3-benzodioxol-5-ylmethyliminomethyl)-4-chloranyl-6-nitro-phenolate

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyliminomethyl)-4-chloranyl-6-nitro-phenolate Openeye Name: 2-(1,3-benzodioxol-5-ylmethyliminomethyl)-4-chloro-6-nitro-phenolate CAS Name: 2-(1,3-benzodioxol-5-ylmethyliminomethyl)-4-chloro-6-nitrophenolate IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyliminomethyl)-4-chloro-6-nitrophenolate Traditional Name: 4-chloro-2-nitro-6-(piperonyliminomethyl)phenolate Formula: C15H10ClN2O5- MolecularWeight: 333.7033

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN2O5/c16-11-4-10(15(19)12(5-11)18(20)21)7-17-6-9-1-2-13-14(3-9)23-8-22-13/h1-5,7,19H,6,8H2/p-1