1-[4-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]sulfonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]sulfonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]sulfonylphenyl]pyrrolidin-2-one CAS Name: 1-[4-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)propyl]sulfonylphenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]sulfonylphenyl]pyrrolidin-2-one Traditional Name: 1-[4-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]sulfonylphenyl]-2-pyrrolidone Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)N2CCCC2=O)N3CC[NH+](CC3)C

Isomeric SMILES

C[C@H](CS(=O)(=O)C1=CC=C(C=C1)N2CCCC2=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H27N3O3S/c1-15(20-12-10-19(2)11-13-20)14-25(23,24)17-7-5-16(6-8-17)21-9-3-4-18(21)22/h5-8,15H,3-4,9-14H2,1-2H3/p+1/t15-/m1/s1