(3R)-3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-methyl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-methyl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-1-methyl-pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]-1-methylpyrrolidine-2,5-dione IUPAC Name: (3R)-3-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-methylpyrrolidine-2,5-dione Traditional Name: (3R)-3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-1-methyl-pyrrolidine-2,5-quinone Formula: C13H17ClN3O4S2+ MolecularWeight: 378.87478

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(C1=O)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CN1C(=O)C[C@H](C1=O)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C13H16ClN3O4S2/c1-15-11(18)8-9(13(15)19)16-4-6-17(7-5-16)23(20,21)12-3-2-10(14)22-12/h2-3,9H,4-8H2,1H3/p+1/t9-/m1/s1