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2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name:2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid
Openeye Name:2-[2-(diethylamino)-2-oxo-ethyl]sulfanylbenzoic acid
CAS Name:2-[[2-(diethylamino)-2-oxoethyl]thio]benzoic acid
IUPAC Name:2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzoic acid
Traditional Name:2-[[2-(diethylamino)-2-keto-ethyl]thio]benzoic acid
Formula: C13H17NO3S
MolecularWeight: 267.34398
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=CC=CC=C1C(=O)O


Isomeric SMILES

CCN(CC)C(=O)CSC1=CC=CC=C1C(=O)O


InChI

InChI=1S/C13H17NO3S/c1-3-14(4-2)12(15)9-18-11-8-6-5-7-10(11)13(16)17/h5-8H,3-4,9H2,1-2H3,(H,16,17)


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