2-azanyl-5-(4-hydroxyphenyl)-2-methyl-3-oxidanylidene-4-(sulfanylmethyl)hexanoic acid

Systemtic Name: 2-azanyl-5-(4-hydroxyphenyl)-2-methyl-3-oxidanylidene-4-(sulfanylmethyl)hexanoic acid Openeye Name: 2-amino-5-(4-hydroxyphenyl)-2-methyl-3-oxo-4-(sulfanylmethyl)hexanoic acid CAS Name: 2-amino-5-(4-hydroxyphenyl)-4-(mercaptomethyl)-2-methyl-3-oxohexanoic acid IUPAC Name: 2-amino-5-(4-hydroxyphenyl)-2-methyl-3-oxo-4-(sulfanylmethyl)hexanoic acid Traditional Name: 2-amino-5-(4-hydroxyphenyl)-3-keto-4-(mercaptomethyl)-2-methyl-hexanoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)O)C(CS)C(=O)C(C)(C(=O)O)N

Isomeric SMILES

CC(C1=CC=C(C=C1)O)C(CS)C(=O)C(C)(C(=O)O)N

InChI

InChI=1S/C14H19NO4S/c1-8(9-3-5-10(16)6-4-9)11(7-20)12(17)14(2,15)13(18)19/h3-6,8,11,16,20H,7,15H2,1-2H3,(H,18,19)