2-[1,3-bis(oxidanylidene)-2-[3-(phenylcarbonyl)thiophen-2-yl]isoindol-2-ium-2-yl]ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)-2-[3-(phenylcarbonyl)thiophen-2-yl]isoindol-2-ium-2-yl]ethanamide Openeye Name: 2-[2-(3-benzoyl-2-thienyl)-1,3-dioxo-isoindolin-2-ium-2-yl]acetamide CAS Name: 2-[2-(3-benzoyl-2-thiophenyl)-1,3-dioxo-2-isoindol-2-iumyl]acetamide IUPAC Name: 2-[2-(3-benzoylthiophen-2-yl)-1,3-dioxoisoindol-2-ium-2-yl]acetamide Traditional Name: 2-[2-(3-benzoyl-2-thienyl)-1,3-diketo-isoindolin-2-ium-2-yl]acetamide Formula: C21H15N2O4S+ MolecularWeight: 391.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(SC=C2)[N+]3(C(=O)C4=CC=CC=C4C3=O)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(SC=C2)[N+]3(C(=O)C4=CC=CC=C4C3=O)CC(=O)N

InChI

InChI=1S/C21H14N2O4S/c22-17(24)12-23(19(26)14-8-4-5-9-15(14)20(23)27)21-16(10-11-28-21)18(25)13-6-2-1-3-7-13/h1-11H,12H2,(H-,22,24)/p+1