1-chloranyl-4-nitro-7-oxidanyl-thioxanthen-9-one

Systemtic Name: 1-chloranyl-4-nitro-7-oxidanyl-thioxanthen-9-one Openeye Name: 1-chloro-7-hydroxy-4-nitro-thioxanthen-9-one CAS Name: 1-chloro-7-hydroxy-4-nitro-9-thioxanthenone IUPAC Name: 1-chloro-7-hydroxy-4-nitrothioxanthen-9-one Traditional Name: 1-chloro-7-hydroxy-4-nitro-thioxanthen-9-one Formula: C13H6ClNO4S MolecularWeight: 307.70904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=O)C3=C(C=CC(=C3S2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC2=C(C=C1O)C(=O)C3=C(C=CC(=C3S2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H6ClNO4S/c14-8-2-3-9(15(18)19)13-11(8)12(17)7-5-6(16)1-4-10(7)20-13/h1-5,16H