Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
Methylene blue	61-73-4	6099

Structure

Other Information

Canonical SMILES	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]
Iso SMILES	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]
InChI	InChI=1S/C16H18N3S.ClH/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;/h5-10H,1-4H3;1H/q+1;/p-1
InChI Key	CXKWCBBOMKCUKX-UHFFFAOYSA-M
Formula	C16H18ClN3S
Mol Weight	319.852
XlogP3	0
Charge	0

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Synonyms Information

CAS Name	[7-(dimethylamino)-3-phenothiazinylidene]-dimethylammonium chloride
IUPAC Name	[7-(dimethylamino)phenothiazin-3-ylidene]-dimethyl-ammonium chloride
Openeye Name	[7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium chloride
Systematic Name	[7-(dimethylamino)phenothiazin-3-ylidene]-dimethyl-azanium chloride
Tratitional Name	[7-(dimethylamino)phenothiazin-3-ylidene]-dimethyl-azanium chloride