diethyl 2-[(E)-3-[(S)-tert-butylsulfinyl]prop-2-enyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[(E)-3-[(S)-tert-butylsulfinyl]prop-2-enyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[(E)-3-[(S)-tert-butylsulfinyl]allyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(E)-3-[(S)-tert-butylsulfinyl]prop-2-enyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-3-[(S)-tert-butylsulfinyl]prop-2-enyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[(E)-3-[(S)-tert-butylsulfinyl]allyl]-2-propargyl-malonic acid diethyl ester Formula: C17H26O5S MolecularWeight: 342.45034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=CS(=O)C(C)(C)C)(CC#C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C/C=C/[S@](=O)C(C)(C)C)(CC#C)C(=O)OCC

InChI

InChI=1S/C17H26O5S/c1-7-11-17(14(18)21-8-2,15(19)22-9-3)12-10-13-23(20)16(4,5)6/h1,10,13H,8-9,11-12H2,2-6H3/b13-10+/t23-/m0/s1