(2R)-N-ethyl-2-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]propanamide

Systemtic Name: (2R)-N-ethyl-2-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]propanamide Openeye Name: (2R)-N-ethyl-2-[[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]propanamide CAS Name: (2R)-N-ethyl-2-[[1-oxo-2-[4-(4-propylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]amino]propanamide IUPAC Name: (2R)-N-ethyl-2-[[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]propanamide Traditional Name: (2R)-N-ethyl-2-[[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]propionamide Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(C)C(=O)NCC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N[C@H](C)C(=O)NCC

InChI

InChI=1S/C20H32N4O4S/c1-4-6-17-7-9-18(10-8-17)29(27,28)24-13-11-23(12-14-24)15-19(25)22-16(3)20(26)21-5-2/h7-10,16H,4-6,11-15H2,1-3H3,(H,21,26)(H,22,25)/p+1/t16-/m1/s1