3-chloranyl-5-nitro-N-(8-nitro-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-3-yl)benzamide

Systemtic Name: 3-chloranyl-5-nitro-N-(8-nitro-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-3-yl)benzamide Openeye Name: 3-chloro-5-nitro-N-(8-nitro-2-oxo-1,3-dihydro-1,5-benzodiazepin-3-yl)benzamide CAS Name: 3-chloro-5-nitro-N-(8-nitro-2-oxo-1,3-dihydro-1,5-benzodiazepin-3-yl)benzamide IUPAC Name: 3-chloro-5-nitro-N-(8-nitro-2-oxo-1,3-dihydro-1,5-benzodiazepin-3-yl)benzamide Traditional Name: 3-chloro-N-(2-keto-8-nitro-1,3-dihydro-1,5-benzodiazepin-3-yl)-5-nitro-benzamide Formula: C16H10ClN5O6 MolecularWeight: 403.7335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)C(C=N2)NC(=O)C3=CC(=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)C(C=N2)NC(=O)C3=CC(=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN5O6/c17-9-3-8(4-11(5-9)22(27)28)15(23)20-14-7-18-12-2-1-10(21(25)26)6-13(12)19-16(14)24/h1-7,14H,(H,19,24)(H,20,23)