1-(3,7-dinitro-5-oxidanylidene-phenothiazin-10-yl)ethanone

Systemtic Name: 1-(3,7-dinitro-5-oxidanylidene-phenothiazin-10-yl)ethanone Openeye Name: 1-(3,7-dinitro-5-oxo-phenothiazin-10-yl)ethanone CAS Name: 1-(3,7-dinitro-5-oxo-10-phenothiazinyl)ethanone IUPAC Name: 1-(3,7-dinitro-5-oxophenothiazin-10-yl)ethanone Traditional Name: 1-(5-keto-3,7-dinitro-phenothiazin-10-yl)ethanone Formula: C14H9N3O6S MolecularWeight: 347.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)C3=C1C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)C3=C1C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O6S/c1-8(18)15-11-4-2-9(16(19)20)6-13(11)24(23)14-7-10(17(21)22)3-5-12(14)15/h2-7H,1H3