1-(3-methoxy-4-nitro-phenyl)-1-sulfanyl-ethanol

Systemtic Name: 1-(3-methoxy-4-nitro-phenyl)-1-sulfanyl-ethanol Openeye Name: 1-(3-methoxy-4-nitro-phenyl)-1-sulfanyl-ethanol CAS Name: 1-mercapto-1-(3-methoxy-4-nitrophenyl)ethanol IUPAC Name: 1-(3-methoxy-4-nitrophenyl)-1-sulfanylethanol Traditional Name: 1-mercapto-1-(3-methoxy-4-nitro-phenyl)ethanol Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)[N+](=O)[O-])OC)(O)S

Isomeric SMILES

CC(C1=CC(=C(C=C1)[N+](=O)[O-])OC)(O)S

InChI

InChI=1S/C9H11NO4S/c1-9(11,15)6-3-4-7(10(12)13)8(5-6)14-2/h3-5,11,15H,1-2H3