(2R)-N,N-dimethyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N,N-dimethyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dimethyl-propanamide CAS Name: (2R)-N,N-dimethyl-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N,N-dimethyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N,N-dimethyl-2-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)propionamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)N(C)C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H29N3O3S/c1-14(2)16-6-8-17(9-7-16)25(23,24)21-12-10-20(11-13-21)15(3)18(22)19(4)5/h6-9,14-15H,10-13H2,1-5H3/p+1/t15-/m1/s1