(2R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide

Systemtic Name: (2R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C16H22Cl2N3O3S+ MolecularWeight: 407.33518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H21Cl2N3O3S/c1-3-6-19-16(22)12(2)20-7-9-21(10-8-20)25(23,24)13-4-5-14(17)15(18)11-13/h3-5,11-12H,1,6-10H2,2H3,(H,19,22)/p+1/t12-/m1/s1