4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzoic acid

Systemtic Name: 4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzoic acid Openeye Name: 4-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzoic acid CAS Name: 4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzoic acid IUPAC Name: 4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzoic acid Traditional Name: 4-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzoic acid Formula: C15H10N2O6 MolecularWeight: 314.2497

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H10N2O6/c18-15(19)9-1-3-11(4-2-9)16-7-10-5-13-14(23-8-22-13)6-12(10)17(20)21/h1-7H,8H2,(H,18,19)