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(2R)-N-cyclopentyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide
(2R)-N-cyclopentyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)C(C)C(=O)NC3CCCC3)C)C
Isomeric SMILES
CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)NC3CCCC3)C)C
InChI
InChI=1S/C22H35N3O3S/c1-15-14-16(2)18(4)21(17(15)3)29(27,28)25-12-10-24(11-13-25)19(5)22(26)23-20-8-6-7-9-20/h14,19-20H,6-13H2,1-5H3,(H,23,26)/p+1/t19-/m1/s1
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