(2R,3S)-3-(4-methoxyphenyl)-3-(2-nitrophenyl)sulfanyl-2-oxidanyl-propanoic acid

Systemtic Name: (2R,3S)-3-(4-methoxyphenyl)-3-(2-nitrophenyl)sulfanyl-2-oxidanyl-propanoic acid Openeye Name: (2R,3S)-2-hydroxy-3-(4-methoxyphenyl)-3-(2-nitrophenyl)sulfanyl-propanoic acid CAS Name: (2R,3S)-2-hydroxy-3-(4-methoxyphenyl)-3-[(2-nitrophenyl)thio]propanoic acid IUPAC Name: (2R,3S)-2-hydroxy-3-(4-methoxyphenyl)-3-(2-nitrophenyl)sulfanylpropanoic acid Traditional Name: (2R,3S)-2-hydroxy-3-(4-methoxyphenyl)-3-[(2-nitrophenyl)thio]propionic acid Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C(=O)O)O)SC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]([C@@H](C(=O)O)O)SC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15NO6S/c1-23-11-8-6-10(7-9-11)15(14(18)16(19)20)24-13-5-3-2-4-12(13)17(21)22/h2-9,14-15,18H,1H3,(H,19,20)/t14-,15-/m0/s1