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aniline; 2-sulfanylpropanoic acid

aniline; 2-sulfanylpropanoic acid

Systemtic Name:aniline; 2-sulfanylpropanoic acid
Openeye Name:aniline; 2-sulfanylpropanoic acid
CAS Name:aniline; 2-mercaptopropanoic acid
IUPAC Name:aniline; 2-sulfanylpropanoic acid
Traditional Name:2-mercaptopropionic acid; phenylamine
Formula: C9H13NO2S
MolecularWeight: 199.27002
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S.C1=CC=C(C=C1)N


Isomeric SMILES

CC(C(=O)O)S.C1=CC=C(C=C1)N


InChI

InChI=1S/C6H7N.C3H6O2S/c7-6-4-2-1-3-5-6;1-2(6)3(4)5/h1-5H,7H2;2,6H,1H3,(H,4,5)


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