tert-butyl (3S)-2-methylidene-3-[[(S)-(4-methylphenyl)sulfinyl]amino]hexanoate

Systemtic Name: tert-butyl (3S)-2-methylidene-3-[[(S)-(4-methylphenyl)sulfinyl]amino]hexanoate Openeye Name: tert-butyl (3S)-2-methylene-3-[[(S)-p-tolylsulfinyl]amino]hexanoate CAS Name: (3S)-2-methylene-3-[[(S)-(4-methylphenyl)sulfinyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-2-methylidene-3-[[(S)-(4-methylphenyl)sulfinyl]amino]hexanoate Traditional Name: 2-[(1S)-1-[[(S)-p-tolylsulfinyl]amino]butyl]acrylic acid tert-butyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=C)C(=O)OC(C)(C)C)NS(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC[C@@H](C(=C)C(=O)OC(C)(C)C)N[S@@](=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C18H27NO3S/c1-7-8-16(14(3)17(20)22-18(4,5)6)19-23(21)15-11-9-13(2)10-12-15/h9-12,16,19H,3,7-8H2,1-2,4-6H3/t16-,23-/m0/s1