2-chloranyl-5-nitro-N-phenyl-benzamide; 2-chloranyl-5-nitro-N-pyridin-4-yl-benzamide

Systemtic Name: 2-chloranyl-5-nitro-N-phenyl-benzamide; 2-chloranyl-5-nitro-N-pyridin-4-yl-benzamide Openeye Name: 2-chloro-5-nitro-N-phenyl-benzamide; 2-chloro-5-nitro-N-(4-pyridyl)benzamide CAS Name: 2-chloro-5-nitro-N-phenylbenzamide; 2-chloro-5-nitro-N-pyridin-4-ylbenzamide IUPAC Name: 2-chloro-5-nitro-N-phenylbenzamide; 2-chloro-5-nitro-N-pyridin-4-ylbenzamide Traditional Name: 2-chloro-5-nitro-N-phenyl-benzamide; 2-chloro-5-nitro-N-(4-pyridyl)benzamide Formula: C25H17Cl2N5O6 MolecularWeight: 554.33838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)NC2=CC=NC=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)NC2=CC=NC=C2)Cl

InChI

InChI=1S/C13H9ClN2O3.C12H8ClN3O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9;13-11-2-1-9(16(18)19)7-10(11)12(17)15-8-3-5-14-6-4-8/h1-8H,(H,15,17);1-7H,(H,14,15,17)