3,3-dimethyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]butan-2-one Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-3,3-dimethyl-butan-2-one CAS Name: 3,3-dimethyl-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]-2-butanone IUPAC Name: 3,3-dimethyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]butan-2-one Traditional Name: 3,3-dimethyl-1-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)butan-2-one Formula: C19H31N2O3S+ MolecularWeight: 367.52604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)C(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)C(C)(C)C

InChI

InChI=1S/C19H30N2O3S/c1-15(2)16-6-8-17(9-7-16)25(23,24)21-12-10-20(11-13-21)14-18(22)19(3,4)5/h6-9,15H,10-14H2,1-5H3/p+1