(2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: (2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: (2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propanoate IUPAC Name: (2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)-3-(4-hydroxyphenyl)propionate Formula: C13H18NO5S- MolecularWeight: 300.35072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=CC=C(C=C1)O)C(=O)[O-]

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-]

InChI

InChI=1S/C13H19NO5S/c1-2-3-8-20(18,19)14-12(13(16)17)9-10-4-6-11(15)7-5-10/h4-7,12,14-15H,2-3,8-9H2,1H3,(H,16,17)/p-1/t12-/m0/s1