ethyl 2-azanyl-3-[2,5-bis(oxidanyl)phenyl]sulfanyl-propanoate

Systemtic Name: ethyl 2-azanyl-3-[2,5-bis(oxidanyl)phenyl]sulfanyl-propanoate Openeye Name: ethyl 2-amino-3-(2,5-dihydroxyphenyl)sulfanyl-propanoate CAS Name: 2-amino-3-[(2,5-dihydroxyphenyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-(2,5-dihydroxyphenyl)sulfanylpropanoate Traditional Name: 2-amino-3-[(2,5-dihydroxyphenyl)thio]propionic acid ethyl ester Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC1=C(C=CC(=C1)O)O)N

Isomeric SMILES

CCOC(=O)C(CSC1=C(C=CC(=C1)O)O)N

InChI

InChI=1S/C11H15NO4S/c1-2-16-11(15)8(12)6-17-10-5-7(13)3-4-9(10)14/h3-5,8,13-14H,2,6,12H2,1H3