6-chloranyl-4-nitro-2-oxidanylidene-1,3-benzoxathiol-5-olate; cyclohexylazanium

Systemtic Name: 6-chloranyl-4-nitro-2-oxidanylidene-1,3-benzoxathiol-5-olate; cyclohexylazanium Openeye Name: 6-chloro-4-nitro-2-oxo-1,3-benzoxathiol-5-olate; cyclohexylammonium CAS Name: 6-chloro-4-nitro-2-oxo-1,3-benzoxathiol-5-olate; cyclohexylammonium IUPAC Name: 6-chloro-4-nitro-2-oxo-1,3-benzoxathiol-5-olate; cyclohexylazanium Traditional Name: 6-chloro-2-keto-4-nitro-1,3-benzoxathiol-5-olate; cyclohexylammonium Formula: C13H15ClN2O5S MolecularWeight: 346.7866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH3+].C1=C2C(=C(C(=C1Cl)[O-])[N+](=O)[O-])SC(=O)O2

Isomeric SMILES

C1CCC(CC1)[NH3+].C1=C2C(=C(C(=C1Cl)[O-])[N+](=O)[O-])SC(=O)O2

InChI

InChI=1S/C7H2ClNO5S.C6H13N/c8-2-1-3-6(15-7(11)14-3)4(5(2)10)9(12)13;7-6-4-2-1-3-5-6/h1,10H;6H,1-5,7H2