[(E)-[azanyl(pyridin-2-yl)methylidene]amino] 4-iodanylbenzoate

Systemtic Name: [(E)-[azanyl(pyridin-2-yl)methylidene]amino] 4-iodanylbenzoate Openeye Name: [(E)-[amino(2-pyridyl)methylene]amino] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [(E)-[amino(2-pyridinyl)methylidene]amino] ester IUPAC Name: [(E)-[amino(pyridin-2-yl)methylidene]amino] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [(E)-[amino(2-pyridyl)methylene]amino] ester Formula: C13H10IN3O2 MolecularWeight: 367.14187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=NOC(=O)C2=CC=C(C=C2)I)N

Isomeric SMILES

C1=CC=NC(=C1)/C(=N\OC(=O)C2=CC=C(C=C2)I)/N

InChI

InChI=1S/C13H10IN3O2/c14-10-6-4-9(5-7-10)13(18)19-17-12(15)11-3-1-2-8-16-11/h1-8H,(H2,15,17)