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2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]ethylazanium bromide

2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]ethylazanium bromide

Systemtic Name:2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]ethylazanium bromide
Openeye Name:2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]ethylammonium bromide
CAS Name:2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]ethylammonium bromide
IUPAC Name:2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]ethylazanium bromide
Traditional Name:2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]ethylammonium bromide
Formula: C13H16BrNO3S
MolecularWeight: 346.24004
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC[NH3+].[Br-]


Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC[NH3+].[Br-]


InChI

InChI=1S/C13H15NO3S.BrH/c1-16-10-2-3-11-9(8-18-5-4-14)6-13(15)17-12(11)7-10;/h2-3,6-7H,4-5,8,14H2,1H3;1H


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