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2-[6-oxidanylidene-1-[(4-phenoxyphenyl)methyl]piperidin-3-yl]ethanethioate

2-[6-oxidanylidene-1-[(4-phenoxyphenyl)methyl]piperidin-3-yl]ethanethioate

Systemtic Name:2-[6-oxidanylidene-1-[(4-phenoxyphenyl)methyl]piperidin-3-yl]ethanethioate
Openeye Name:2-[6-oxo-1-[(4-phenoxyphenyl)methyl]-3-piperidyl]ethanethioate
CAS Name:2-[6-oxo-1-[(4-phenoxyphenyl)methyl]-3-piperidinyl]ethanethioate
IUPAC Name:2-[6-oxo-1-[(4-phenoxyphenyl)methyl]piperidin-3-yl]ethanethioate
Traditional Name:2-[6-keto-1-(4-phenoxybenzyl)-3-piperidyl]thioacetate
Formula: C20H20NO3S-
MolecularWeight: 354.4427
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1CC(=S)[O-])CC2=CC=C(C=C2)OC3=CC=CC=C3


Isomeric SMILES

C1CC(=O)N(CC1CC(=S)[O-])CC2=CC=C(C=C2)OC3=CC=CC=C3


InChI

InChI=1S/C20H21NO3S/c22-19-11-8-16(12-20(23)25)14-21(19)13-15-6-9-18(10-7-15)24-17-4-2-1-3-5-17/h1-7,9-10,16H,8,11-14H2,(H,23,25)/p-1


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