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2-[(3S)-2-oxidanylideneazepan-3-yl]sulfanylethanoate

2-[(3S)-2-oxidanylideneazepan-3-yl]sulfanylethanoate

Systemtic Name:2-[(3S)-2-oxidanylideneazepan-3-yl]sulfanylethanoate
Openeye Name:2-[(3S)-2-oxoazepan-3-yl]sulfanylacetate
CAS Name:2-[[(3S)-2-oxo-3-azepanyl]thio]acetate
IUPAC Name:2-[(3S)-2-oxoazepan-3-yl]sulfanylacetate
Traditional Name:2-[[(3S)-2-ketoazepan-3-yl]thio]acetate
Formula: C8H12NO3S-
MolecularWeight: 202.25078
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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SCC(=O)[O-]


Isomeric SMILES

C1CCNC(=O)[C@H](C1)SCC(=O)[O-]


InChI

InChI=1S/C8H13NO3S/c10-7(11)5-13-6-3-1-2-4-9-8(6)12/h6H,1-5H2,(H,9,12)(H,10,11)/p-1/t6-/m0/s1


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