2-(1,3-benzodioxol-5-ylmethylideneamino)-5-bromanyl-benzoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-5-bromanyl-benzoic acid Openeye Name: 2-(1,3-benzodioxol-5-ylmethyleneamino)-5-bromo-benzoic acid CAS Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-5-bromobenzoic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-5-bromobenzoic acid Traditional Name: 5-bromo-2-(piperonylideneamino)benzoic acid Formula: C15H10BrNO4 MolecularWeight: 348.1482

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C15H10BrNO4/c16-10-2-3-12(11(6-10)15(18)19)17-7-9-1-4-13-14(5-9)21-8-20-13/h1-7H,8H2,(H,18,19)