2-[(2-chloranyl-4-ethynyl-phenyl)amino]-4-nitro-N-oxidanyl-benzamide

Systemtic Name: 2-[(2-chloranyl-4-ethynyl-phenyl)amino]-4-nitro-N-oxidanyl-benzamide Openeye Name: 2-(2-chloro-4-ethynyl-anilino)-4-nitro-benzenecarbohydroxamic acid CAS Name: 2-(2-chloro-4-ethynylanilino)-N-hydroxy-4-nitrobenzamide IUPAC Name: 2-(2-chloro-4-ethynylanilino)-N-hydroxy-4-nitrobenzamide Traditional Name: 2-(2-chloro-4-ethynyl-anilino)-4-nitro-benzenecarbohydroxamic acid Formula: C15H10ClN3O4 MolecularWeight: 331.7106

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=C(C=C1)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)NO)Cl

Isomeric SMILES

C#CC1=CC(=C(C=C1)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)NO)Cl

InChI

InChI=1S/C15H10ClN3O4/c1-2-9-3-6-13(12(16)7-9)17-14-8-10(19(22)23)4-5-11(14)15(20)18-21/h1,3-8,17,21H,(H,18,20)