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[7-(dibutylamino)phenothiazin-3-ylidene]-dipropyl-azanium iodide

[7-(dibutylamino)phenothiazin-3-ylidene]-dipropyl-azanium iodide

Systemtic Name:[7-(dibutylamino)phenothiazin-3-ylidene]-dipropyl-azanium iodide
Openeye Name:[7-(dibutylamino)phenothiazin-3-ylidene]-dipropyl-ammonium iodide
CAS Name:[7-(dibutylamino)-3-phenothiazinylidene]-dipropylammonium iodide
IUPAC Name:[7-(dibutylamino)phenothiazin-3-ylidene]-dipropylazanium iodide
Traditional Name:[7-(dibutylamino)phenothiazin-3-ylidene]-dipropyl-ammonium iodide
Formula: C26H38IN3S
MolecularWeight: 551.56949
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CCC)CCC)C=C3S2.[I-]


Isomeric SMILES

CCCCN(CCCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CCC)CCC)C=C3S2.[I-]


InChI

InChI=1S/C26H38N3S.HI/c1-5-9-17-29(18-10-6-2)22-12-14-24-26(20-22)30-25-19-21(11-13-23(25)27-24)28(15-7-3)16-8-4;/h11-14,19-20H,5-10,15-18H2,1-4H3;1H/q+1;/p-1


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