2-[(R)-(4-nitrophenyl)-oxidanyl-methyl]sulfanylethylazanium

Systemtic Name: 2-[(R)-(4-nitrophenyl)-oxidanyl-methyl]sulfanylethylazanium Openeye Name: 2-[(R)-hydroxy-(4-nitrophenyl)methyl]sulfanylethylammonium CAS Name: 2-[[(R)-hydroxy-(4-nitrophenyl)methyl]thio]ethylammonium IUPAC Name: 2-[(R)-hydroxy-(4-nitrophenyl)methyl]sulfanylethylazanium Traditional Name: 2-[[(R)-hydroxy-(4-nitrophenyl)methyl]thio]ethylammonium Formula: C9H13N2O3S+ MolecularWeight: 229.27612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(O)SCC[NH3+])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[C@H](O)SCC[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O3S/c10-5-6-15-9(12)7-1-3-8(4-2-7)11(13)14/h1-4,9,12H,5-6,10H2/p+1/t9-/m1/s1