2-(2-nitrophenyl)-3,1-benzoxathiin-4-one

Systemtic Name: 2-(2-nitrophenyl)-3,1-benzoxathiin-4-one Openeye Name: 2-(2-nitrophenyl)-3,1-benzoxathiin-4-one CAS Name: 2-(2-nitrophenyl)-3,1-benzoxathiin-4-one IUPAC Name: 2-(2-nitrophenyl)-3,1-benzoxathiin-4-one Traditional Name: 2-(2-nitrophenyl)-3,1-benzoxathiin-4-one Formula: C14H9NO4S MolecularWeight: 287.29056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2OC(=O)C3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2OC(=O)C3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C14H9NO4S/c16-13-10-6-2-4-8-12(10)20-14(19-13)9-5-1-3-7-11(9)15(17)18/h1-8,14H