[(E)-[azanyl(pyridin-3-yl)methylidene]amino] 3-bromanylbenzoate

Systemtic Name: [(E)-[azanyl(pyridin-3-yl)methylidene]amino] 3-bromanylbenzoate Openeye Name: [(E)-[amino(3-pyridyl)methylene]amino] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [(E)-[amino(3-pyridinyl)methylidene]amino] ester IUPAC Name: [(E)-[amino(pyridin-3-yl)methylidene]amino] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [(E)-[amino(3-pyridyl)methylene]amino] ester Formula: C13H10BrN3O2 MolecularWeight: 320.1414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)ON=C(C2=CN=CC=C2)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)O/N=C(\C2=CN=CC=C2)/N

InChI

InChI=1S/C13H10BrN3O2/c14-11-5-1-3-9(7-11)13(18)19-17-12(15)10-4-2-6-16-8-10/h1-8H,(H2,15,17)