1-chloranyl-2-methoxy-4-nitro-thioxanthen-9-one

Systemtic Name: 1-chloranyl-2-methoxy-4-nitro-thioxanthen-9-one Openeye Name: 1-chloro-2-methoxy-4-nitro-thioxanthen-9-one CAS Name: 1-chloro-2-methoxy-4-nitro-9-thioxanthenone IUPAC Name: 1-chloro-2-methoxy-4-nitrothioxanthen-9-one Traditional Name: 1-chloro-2-methoxy-4-nitro-thioxanthen-9-one Formula: C14H8ClNO4S MolecularWeight: 321.73562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C(=C1)[N+](=O)[O-])SC3=CC=CC=C3C2=O)Cl

Isomeric SMILES

COC1=C(C2=C(C(=C1)[N+](=O)[O-])SC3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C14H8ClNO4S/c1-20-9-6-8(16(18)19)14-11(12(9)15)13(17)7-4-2-3-5-10(7)21-14/h2-6H,1H3