3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-phthalimido-benzamide Formula: C25H24N3O4S+ MolecularWeight: 462.54076

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC(=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)C5=CC=CS5

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=CC(=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)C5=CC=CS5

InChI

InChI=1S/C25H23N3O4S/c29-23(26-16-21(22-9-4-14-33-22)27-10-12-32-13-11-27)17-5-3-6-18(15-17)28-24(30)19-7-1-2-8-20(19)25(28)31/h1-9,14-15,21H,10-13,16H2,(H,26,29)/p+1/t21-/m1/s1