2-methyl-4-[4-[(2R)-1,3-thiazolidin-3-ium-2-yl]phenyl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[4-[(2R)-1,3-thiazolidin-3-ium-2-yl]phenyl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[4-[(2R)-thiazolidin-3-ium-2-yl]phenyl]but-3-yn-2-ol CAS Name: 2-methyl-4-[4-[(2R)-2-thiazolidin-3-iumyl]phenyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[4-[(2R)-1,3-thiazolidin-3-ium-2-yl]phenyl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[4-[(2R)-thiazolidin-3-ium-2-yl]phenyl]but-3-yn-2-ol Formula: C14H18NOS+ MolecularWeight: 248.36382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(C=C1)C2[NH2+]CCS2)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(C=C1)[C@@H]2[NH2+]CCS2)O

InChI

InChI=1S/C14H17NOS/c1-14(2,16)8-7-11-3-5-12(6-4-11)13-15-9-10-17-13/h3-6,13,15-16H,9-10H2,1-2H3/p+1/t13-/m1/s1