2-[(4-ethylsulfanylphenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-ethylsulfanylphenyl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-ethylsulfanylbenzoyl)amino]acetic acid CAS Name: 2-[[[4-(ethylthio)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-ethylsulfanylbenzoyl)amino]acetic acid Traditional Name: 2-[[4-(ethylthio)benzoyl]amino]acetic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)NCC(=O)O

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)NCC(=O)O

InChI

InChI=1S/C11H13NO3S/c1-2-16-9-5-3-8(4-6-9)11(15)12-7-10(13)14/h3-6H,2,7H2,1H3,(H,12,15)(H,13,14)