2-phenothiazin-3-ylidenepyrrolo[3,4-f]isoindol-2-ium-1,3,5,7-tetrone

Systemtic Name: 2-phenothiazin-3-ylidenepyrrolo[3,4-f]isoindol-2-ium-1,3,5,7-tetrone Openeye Name: 2-phenothiazin-3-ylidenepyrrolo[3,4-f]isoindol-2-ium-1,3,5,7-tetrone CAS Name: 2-(3-phenothiazinylidene)pyrrolo[3,4-f]isoindol-2-ium-1,3,5,7-tetrone IUPAC Name: 2-phenothiazin-3-ylidenepyrrolo[3,4-f]isoindol-2-ium-1,3,5,7-tetrone Traditional Name: 2-phenothiazin-3-ylidenepyrrol[3,4-f]isoindol-2-ium-1,3,5,7-diquinone Formula: C22H10N3O4S+ MolecularWeight: 412.3975

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C=CC(=[N+]4C(=O)C5=C(C4=O)C=C6C(=C5)C(=O)NC6=O)C=C3S2

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C=CC(=[N+]4C(=O)C5=C(C4=O)C=C6C(=C5)C(=O)NC6=O)C=C3S2

InChI

InChI=1S/C22H9N3O4S/c26-19-11-8-13-14(9-12(11)20(27)24-19)22(29)25(21(13)28)10-5-6-16-18(7-10)30-17-4-2-1-3-15(17)23-16/h1-9H/p+1