1-[(2S,3S)-3-phenyl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]nonan-1-one

Systemtic Name: 1-[(2S,3S)-3-phenyl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]nonan-1-one Openeye Name: 1-[(2S,3S)-3-phenyl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]nonan-1-one CAS Name: 1-[(2S,3S)-3-phenyl-1-(2,4,6-trimethylphenyl)sulfonyl-2-aziridinyl]-1-nonanone IUPAC Name: 1-[(2S,3S)-3-phenyl-1-(2,4,6-trimethylphenyl)sulfonylaziridin-2-yl]nonan-1-one Traditional Name: 1-[(2S,3S)-1-mesitylsulfonyl-3-phenyl-ethylenimin-2-yl]nonan-1-one Formula: C26H35NO3S MolecularWeight: 441.626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1C(N1S(=O)(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC(=O)[C@@H]1[C@@H](N1S(=O)(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3

InChI

InChI=1S/C26H35NO3S/c1-5-6-7-8-9-13-16-23(28)25-24(22-14-11-10-12-15-22)27(25)31(29,30)26-20(3)17-19(2)18-21(26)4/h10-12,14-15,17-18,24-25H,5-9,13,16H2,1-4H3/t24-,25+,27?/m0/s1