(3R)-1-[2-(4-chlorophenyl)sulfanylphenyl]-3-morpholin-4-ium-4-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-[2-(4-chlorophenyl)sulfanylphenyl]-3-morpholin-4-ium-4-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-1-[2-(4-chlorophenyl)sulfanylphenyl]-3-morpholin-4-ium-4-yl-pyrrolidine-2,5-dione CAS Name: (3R)-1-[2-[(4-chlorophenyl)thio]phenyl]-3-(4-morpholin-4-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-[2-(4-chlorophenyl)sulfanylphenyl]-3-morpholin-4-ium-4-ylpyrrolidine-2,5-dione Traditional Name: (3R)-1-[2-[(4-chlorophenyl)thio]phenyl]-3-morpholin-4-ium-4-yl-pyrrolidine-2,5-quinone Formula: C20H20ClN2O3S+ MolecularWeight: 403.9024

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C2CC(=O)N(C2=O)C3=CC=CC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCC[NH+]1[C@@H]2CC(=O)N(C2=O)C3=CC=CC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H19ClN2O3S/c21-14-5-7-15(8-6-14)27-18-4-2-1-3-16(18)23-19(24)13-17(20(23)25)22-9-11-26-12-10-22/h1-8,17H,9-13H2/p+1/t17-/m1/s1