6-(4-chloranyl-2-nitro-phenyl)hexane-1-thiol

Systemtic Name: 6-(4-chloranyl-2-nitro-phenyl)hexane-1-thiol Openeye Name: 6-(4-chloro-2-nitro-phenyl)hexane-1-thiol CAS Name: 6-(4-chloro-2-nitrophenyl)-1-hexanethiol IUPAC Name: 6-(4-chloro-2-nitrophenyl)hexane-1-thiol Traditional Name: 6-(4-chloro-2-nitro-phenyl)hexane-1-thiol Formula: C12H16ClNO2S MolecularWeight: 273.77894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])CCCCCCS

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])CCCCCCS

InChI

InChI=1S/C12H16ClNO2S/c13-11-7-6-10(12(9-11)14(15)16)5-3-1-2-4-8-17/h6-7,9,17H,1-5,8H2