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

Systemtic Name: (2R)-2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(2-cyanophenyl)sulfonyl-1-piperazin-1-iumyl]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C17H23N4O3S+ MolecularWeight: 363.45452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

C[C@H](C(=O)NCC=C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C17H22N4O3S/c1-3-8-19-17(22)14(2)20-9-11-21(12-10-20)25(23,24)16-7-5-4-6-15(16)13-18/h3-7,14H,1,8-12H2,2H3,(H,19,22)/p+1/t14-/m1/s1