(2R)-2-[4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylhexanoate

Systemtic Name: (2R)-2-[4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylhexanoate Openeye Name: (2R)-2-[4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylhexanoate CAS Name: (2R)-2-[[4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-2-imidazolyl]thio]hexanoate IUPAC Name: (2R)-2-[4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylhexanoate Traditional Name: (2R)-2-[(4-methylol-1-p-anisyl-imidazol-2-yl)thio]hexanoate Formula: C18H23N2O4S- MolecularWeight: 363.45122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])SC1=NC(=CN1CC2=CC=C(C=C2)OC)CO

Isomeric SMILES

CCCC[C@H](C(=O)[O-])SC1=NC(=CN1CC2=CC=C(C=C2)OC)CO

InChI

InChI=1S/C18H24N2O4S/c1-3-4-5-16(17(22)23)25-18-19-14(12-21)11-20(18)10-13-6-8-15(24-2)9-7-13/h6-9,11,16,21H,3-5,10,12H2,1-2H3,(H,22,23)/p-1/t16-/m1/s1