N-(2-chloranyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitro-benzamide

Systemtic Name: N-(2-chloranyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitro-benzamide Openeye Name: N-(2-chloro-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitro-benzamide CAS Name: N-(2-chloro-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitrobenzamide IUPAC Name: N-(2-chloro-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitrobenzamide Traditional Name: N-(2-chloro-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dinitro-benzamide Formula: C20H12ClN5O5 MolecularWeight: 437.79278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N=C4N1C=C(C=C4)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N=C4N1C=C(C=C4)Cl

InChI

InChI=1S/C20H12ClN5O5/c21-14-5-6-18-22-19(17-4-2-1-3-12(17)10-24(18)11-14)23-20(27)13-7-15(25(28)29)9-16(8-13)26(30)31/h1-9,11H,10H2