3-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]sulfanylphenol

Systemtic Name: 3-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]sulfanylphenol Openeye Name: 3-[2-hydroxy-3-(4-nitrophenoxy)propyl]sulfanylphenol CAS Name: 3-[[2-hydroxy-3-(4-nitrophenoxy)propyl]thio]phenol IUPAC Name: 3-[2-hydroxy-3-(4-nitrophenoxy)propyl]sulfanylphenol Traditional Name: 3-[[2-hydroxy-3-(4-nitrophenoxy)propyl]thio]phenol Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)O

Isomeric SMILES

C1=CC(=CC(=C1)SCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)O

InChI

InChI=1S/C15H15NO5S/c17-12-2-1-3-15(8-12)22-10-13(18)9-21-14-6-4-11(5-7-14)16(19)20/h1-8,13,17-18H,9-10H2