tert-butyl 2-[(4-methoxyphenyl)sulfonyl-(2-oxidanylidenethiolan-3-yl)amino]ethanoate

Systemtic Name: tert-butyl 2-[(4-methoxyphenyl)sulfonyl-(2-oxidanylidenethiolan-3-yl)amino]ethanoate Openeye Name: tert-butyl 2-[(4-methoxyphenyl)sulfonyl-(2-oxotetrahydrothiophen-3-yl)amino]acetate CAS Name: 2-[(4-methoxyphenyl)sulfonyl-(2-oxo-3-thiolanyl)amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-methoxyphenyl)sulfonyl-(2-oxothiolan-3-yl)amino]acetate Traditional Name: 2-[(2-ketotetrahydrothiophen-3-yl)-(4-methoxyphenyl)sulfonyl-amino]acetic acid tert-butyl ester Formula: C17H23NO6S2 MolecularWeight: 401.49762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C1CCSC1=O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)CN(C1CCSC1=O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H23NO6S2/c1-17(2,3)24-15(19)11-18(14-9-10-25-16(14)20)26(21,22)13-7-5-12(23-4)6-8-13/h5-8,14H,9-11H2,1-4H3