3-[(4-aminocarbonylphenyl)methylsulfanyl]propanoate

Systemtic Name: 3-[(4-aminocarbonylphenyl)methylsulfanyl]propanoate Openeye Name: 3-[(4-carbamoylphenyl)methylsulfanyl]propanoate CAS Name: 3-[(4-carbamoylphenyl)methylthio]propanoate IUPAC Name: 3-[(4-carbamoylphenyl)methylsulfanyl]propanoate Traditional Name: 3-[(4-carbamoylbenzyl)thio]propionate Formula: C11H12NO3S- MolecularWeight: 238.28288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCC(=O)[O-])C(=O)N

Isomeric SMILES

C1=CC(=CC=C1CSCCC(=O)[O-])C(=O)N

InChI

InChI=1S/C11H13NO3S/c12-11(15)9-3-1-8(2-4-9)7-16-6-5-10(13)14/h1-4H,5-7H2,(H2,12,15)(H,13,14)/p-1