2,4,9-trinitro-2H-thiopyrano[3,2-b]chromen-10-one

Systemtic Name: 2,4,9-trinitro-2H-thiopyrano[3,2-b]chromen-10-one Openeye Name: 2,4,9-trinitro-2H-thiopyrano[3,2-b]chromen-10-one CAS Name: 2,4,9-trinitro-2H-thiopyrano[3,2-b][1]benzopyran-10-one IUPAC Name: 2,4,9-trinitro-2H-thiopyrano[3,2-b]chromen-10-one Traditional Name: 2,4,9-trinitro-2H-thiopyrano[3,2-b]chromen-10-one Formula: C12H5N3O8S MolecularWeight: 351.2484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(C2=O)SC(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(C2=O)SC(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H5N3O8S/c16-10-9-5(13(17)18)2-1-3-7(9)23-11-6(14(19)20)4-8(15(21)22)24-12(10)11/h1-4,8H