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1-[4-[(2-ethenylphenyl)methoxy]phenyl]thian-1-ium chloride

1-[4-[(2-ethenylphenyl)methoxy]phenyl]thian-1-ium chloride

Systemtic Name:1-[4-[(2-ethenylphenyl)methoxy]phenyl]thian-1-ium chloride
Openeye Name:1-[4-[(2-vinylphenyl)methoxy]phenyl]tetrahydrothiopyran-1-ium chloride
CAS Name:1-[4-[(2-ethenylphenyl)methoxy]phenyl]thian-1-ium chloride
IUPAC Name:1-[4-[(2-ethenylphenyl)methoxy]phenyl]thian-1-ium chloride
Traditional Name:1-[4-(2-vinylbenzyl)oxyphenyl]tetrahydrothiopyran-1-ium chloride
Formula: C20H23ClOS
MolecularWeight: 346.91402
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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1COC2=CC=C(C=C2)[S+]3CCCCC3.[Cl-]


Isomeric SMILES

C=CC1=CC=CC=C1COC2=CC=C(C=C2)[S+]3CCCCC3.[Cl-]


InChI

InChI=1S/C20H23OS.ClH/c1-2-17-8-4-5-9-18(17)16-21-19-10-12-20(13-11-19)22-14-6-3-7-15-22;/h2,4-5,8-13H,1,3,6-7,14-16H2;1H/q+1;/p-1


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