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2-(dioctylamino)-1-phenoxathiin-2-yl-ethanol hydrochloride

2-(dioctylamino)-1-phenoxathiin-2-yl-ethanol hydrochloride

Systemtic Name:2-(dioctylamino)-1-phenoxathiin-2-yl-ethanol hydrochloride
Openeye Name:2-(dioctylamino)-1-phenoxathiin-2-yl-ethanol hydrochloride
CAS Name:2-(dioctylamino)-1-(2-phenoxathiinyl)ethanol hydrochloride
IUPAC Name:2-(dioctylamino)-1-phenoxathiin-2-ylethanol hydrochloride
Traditional Name:2-(dioctylamino)-1-phenoxathiin-2-yl-ethanol hydrochloride
Formula: C30H46ClNO2S
MolecularWeight: 520.20974
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)CC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)O.Cl


Isomeric SMILES

CCCCCCCCN(CCCCCCCC)CC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)O.Cl


InChI

InChI=1S/C30H45NO2S.ClH/c1-3-5-7-9-11-15-21-31(22-16-12-10-8-6-4-2)24-26(32)25-19-20-28-30(23-25)34-29-18-14-13-17-27(29)33-28;/h13-14,17-20,23,26,32H,3-12,15-16,21-22,24H2,1-2H3;1H


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