3-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanylpropanoic acid

Systemtic Name: 3-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanylpropanoic acid Openeye Name: 3-(3-anilino-3-oxo-propyl)sulfanylpropanoic acid CAS Name: 3-[(3-anilino-3-oxopropyl)thio]propanoic acid IUPAC Name: 3-(3-anilino-3-oxopropyl)sulfanylpropanoic acid Traditional Name: 3-[(3-anilino-3-keto-propyl)thio]propionic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCSCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCSCCC(=O)O

InChI

InChI=1S/C12H15NO3S/c14-11(6-8-17-9-7-12(15)16)13-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,14)(H,15,16)