(2S,5R)-2-ethynyl-5-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine

Systemtic Name: (2S,5R)-2-ethynyl-5-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine Openeye Name: (2S,5R)-2-ethynyl-5-isopropyl-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine CAS Name: (2S,5R)-2-ethynyl-5-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine IUPAC Name: (2S,5R)-2-ethynyl-5-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine Traditional Name: (2S,5R)-2-ethynyl-5-isopropyl-1-mesitylsulfonyl-pyrrolidine Formula: C18H25NO2S MolecularWeight: 319.4616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C(CCC2C(C)C)C#C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2[C@@H](CC[C@@H]2C(C)C)C#C)C

InChI

InChI=1S/C18H25NO2S/c1-7-16-8-9-17(12(2)3)19(16)22(20,21)18-14(5)10-13(4)11-15(18)6/h1,10-12,16-17H,8-9H2,2-6H3/t16-,17-/m1/s1