[(Z)-[azanyl(pyridin-3-yl)methylidene]amino] 2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoate

Systemtic Name: [(Z)-[azanyl(pyridin-3-yl)methylidene]amino] 2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoate Openeye Name: [(Z)-[amino(3-pyridyl)methylene]amino] 2-(2-bromo-4-tert-butyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-tert-butylphenoxy)acetic acid [(Z)-[amino(3-pyridinyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino(pyridin-3-yl)methylidene]amino] 2-(2-bromo-4-tert-butylphenoxy)acetate Traditional Name: 2-(2-bromo-4-tert-butyl-phenoxy)acetic acid [(Z)-[amino(3-pyridyl)methylene]amino] ester Formula: C18H20BrN3O3 MolecularWeight: 406.2737

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrN3O3/c1-18(2,3)13-6-7-15(14(19)9-13)24-11-16(23)25-22-17(20)12-5-4-8-21-10-12/h4-10H,11H2,1-3H3,(H2,20,22)