2-azanyl-6-(2-chloranyl-5-nitro-phenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(2-chloranyl-5-nitro-phenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-6-(2-chloro-5-nitro-phenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-6-(2-chloro-5-nitrophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-chloro-5-nitrophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-6-(2-chloro-5-nitro-phenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C17H16ClN5O4 MolecularWeight: 389.79304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2(C(C2(C(=N1)N)C#N)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C#N)OCC

Isomeric SMILES

CCOC1(C2(C(C2(C(=N1)N)C#N)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C#N)OCC

InChI

InChI=1S/C17H16ClN5O4/c1-3-26-17(27-4-2)16(9-20)13(15(16,8-19)14(21)22-17)11-7-10(23(24)25)5-6-12(11)18/h5-7,13H,3-4H2,1-2H3,(H2,21,22)