methyl 3-[(2S,3S)-3-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]prop-2-ynoate

Systemtic Name: methyl 3-[(2S,3S)-3-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]prop-2-ynoate Openeye Name: methyl 3-[(2S,3S)-3-isopropyl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridin-2-yl]prop-2-ynoate CAS Name: 3-[(2S,3S)-3-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonyl-2-aziridinyl]-2-propynoic acid methyl ester IUPAC Name: methyl 3-[(2S,3S)-3-propan-2-yl-1-(2,4,6-trimethylphenyl)sulfonylaziridin-2-yl]prop-2-ynoate Traditional Name: 3-[(2S,3S)-3-isopropyl-1-mesitylsulfonyl-ethylenimin-2-yl]propiolic acid methyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C(C2C(C)C)C#CC(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO4S/c1-11(2)17-15(7-8-16(20)23-6)19(17)24(21,22)18-13(4)9-12(3)10-14(18)5/h9-11,15,17H,1-6H3/t15-,17-,19?/m0/s1