2-(benzotriazol-1-yl)-N-[(Z)-(5-bromanyl-2-propoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(Z)-(5-bromanyl-2-propoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(Z)-(5-bromo-2-propoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(Z)-(5-bromo-2-propoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(Z)-(5-bromo-2-propoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(Z)-(5-bromo-2-propoxy-benzylidene)amino]acetamide Formula: C18H18BrN5O2 MolecularWeight: 416.27182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C=NNC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)/C=N\NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H18BrN5O2/c1-2-9-26-17-8-7-14(19)10-13(17)11-20-22-18(25)12-24-16-6-4-3-5-15(16)21-23-24/h3-8,10-11H,2,9,12H2,1H3,(H,22,25)/b20-11-