2-[(3-phenyl-2-sulfanyl-propanoyl)amino]ethanoic acid

Systemtic Name: 2-[(3-phenyl-2-sulfanyl-propanoyl)amino]ethanoic acid Openeye Name: 2-[(3-phenyl-2-sulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[(2-mercapto-1-oxo-3-phenylpropyl)amino]acetic acid IUPAC Name: 2-[(3-phenyl-2-sulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[(2-mercapto-3-phenyl-propanoyl)amino]acetic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3S/c13-10(14)7-12-11(15)9(16)6-8-4-2-1-3-5-8/h1-5,9,16H,6-7H2,(H,12,15)(H,13,14)