2-[3-chloranyl-2,5-bis(oxidanylidene)pyrrol-1-ium-1-yl]-N-phenyl-ethanamide chloride

Systemtic Name: 2-[3-chloranyl-2,5-bis(oxidanylidene)pyrrol-1-ium-1-yl]-N-phenyl-ethanamide chloride Openeye Name: 2-(3-chloro-2,5-dioxo-pyrrol-1-ium-1-yl)-N-phenyl-acetamide chloride CAS Name: 2-(3-chloro-2,5-dioxo-1-pyrrol-1-iumyl)-N-phenylacetamide chloride IUPAC Name: 2-(3-chloro-2,5-dioxopyrrol-1-ium-1-yl)-N-phenylacetamide chloride Traditional Name: 2-(3-chloro-2,5-diketo-3-pyrrolin-1-ium-1-yl)-N-phenyl-acetamide chloride Formula: C12H10Cl2N2O3 MolecularWeight: 301.1254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C[NH+]2C(=O)C=C(C2=O)Cl.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C[NH+]2C(=O)C=C(C2=O)Cl.[Cl-]

InChI

InChI=1S/C12H9ClN2O3.ClH/c13-9-6-11(17)15(12(9)18)7-10(16)14-8-4-2-1-3-5-8;/h1-6H,7H2,(H,14,16);1H