[7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-10H-phenothiazin-3-ylidene]-dimethyl-azanium

Systemtic Name: [7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-10H-phenothiazin-3-ylidene]-dimethyl-azanium Openeye Name: [7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-10H-phenothiazin-3-ylidene]-dimethyl-ammonium CAS Name: [7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-10H-phenothiazin-3-ylidene]-dimethylammonium IUPAC Name: [7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-10H-phenothiazin-3-ylidene]-dimethylazanium Traditional Name: [7-(dimethylamino)-8-(4-hydroxyphenyl)-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-10H-phenothiazin-3-ylidene]-dimethyl-ammonium Formula: C28H26N3O2S+ MolecularWeight: 468.58994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1C3=CC=C(C=C3)O)NC4=CC(=C5C=CC(=O)C=C5)C(=[N+](C)C)C=C4S2

Isomeric SMILES

CN(C)C1=CC2=C(C=C1C3=CC=C(C=C3)O)NC4=CC(=C5C=CC(=O)C=C5)C(=[N+](C)C)C=C4S2

InChI

InChI=1S/C28H25N3O2S/c1-30(2)25-15-27-23(13-21(25)17-5-9-19(32)10-6-17)29-24-14-22(18-7-11-20(33)12-8-18)26(31(3)4)16-28(24)34-27/h5-16H,1-4H3,(H-,29,32,33)/p+1