(3S)-3-(aziridin-1-ium-1-yl)-1-(3-chlorophenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(aziridin-1-ium-1-yl)-1-(3-chlorophenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(aziridin-1-ium-1-yl)-1-(3-chlorophenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-(1-aziridin-1-iumyl)-1-(3-chlorophenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(aziridin-1-ium-1-yl)-1-(3-chlorophenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-1-(3-chlorophenyl)-3-ethylenimin-1-ium-1-yl-pyrrolidine-2,5-quinone Formula: C12H12ClN2O2+ MolecularWeight: 251.68888

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]1C2CC(=O)N(C2=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[NH+]1[C@H]2CC(=O)N(C2=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C12H11ClN2O2/c13-8-2-1-3-9(6-8)15-11(16)7-10(12(15)17)14-4-5-14/h1-3,6,10H,4-5,7H2/p+1/t10-/m0/s1