8-bromanyl-1-nitro-phenoxathiine

Systemtic Name: 8-bromanyl-1-nitro-phenoxathiine Openeye Name: 8-bromo-1-nitro-phenoxathiine CAS Name: 8-bromo-1-nitrophenoxathiine IUPAC Name: 8-bromo-1-nitrophenoxathiine Traditional Name: 8-bromo-1-nitro-phenoxathiine Formula: C12H6BrNO3S MolecularWeight: 324.14994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(S2)C=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(S2)C=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H6BrNO3S/c13-7-4-5-9-11(6-7)18-12-8(14(15)16)2-1-3-10(12)17-9/h1-6H