(2-chloranyl-5-nitro-phenyl)-[4-(2-chloranyl-5-nitro-phenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-chloranyl-5-nitro-phenyl)-[4-(2-chloranyl-5-nitro-phenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(2-chloro-5-nitro-benzoyl)-1,4-diazepan-1-yl]-(2-chloro-5-nitro-phenyl)methanone CAS Name: (2-chloro-5-nitrophenyl)-[4-[(2-chloro-5-nitrophenyl)-oxomethyl]-1,4-diazepan-1-yl]methanone IUPAC Name: [4-(2-chloro-5-nitrobenzoyl)-1,4-diazepan-1-yl]-(2-chloro-5-nitrophenyl)methanone Traditional Name: [4-(2-chloro-5-nitro-benzoyl)-1,4-diazepan-1-yl]-(2-chloro-5-nitro-phenyl)methanone Formula: C19H16Cl2N4O6 MolecularWeight: 467.25954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16Cl2N4O6/c20-16-4-2-12(24(28)29)10-14(16)18(26)22-6-1-7-23(9-8-22)19(27)15-11-13(25(30)31)3-5-17(15)21/h2-5,10-11H,1,6-9H2