5-[2-(2-azanylethoxy)phenyl]-2-sulfanyl-benzoic acid

Systemtic Name: 5-[2-(2-azanylethoxy)phenyl]-2-sulfanyl-benzoic acid Openeye Name: 5-[2-(2-aminoethoxy)phenyl]-2-sulfanyl-benzoic acid CAS Name: 5-[2-(2-aminoethoxy)phenyl]-2-mercaptobenzoic acid IUPAC Name: 5-[2-(2-aminoethoxy)phenyl]-2-sulfanylbenzoic acid Traditional Name: 5-[2-(2-aminoethoxy)phenyl]-2-mercapto-benzoic acid Formula: C15H15NO3S MolecularWeight: 289.3495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=C(C=C2)S)C(=O)O)OCCN

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=C(C=C2)S)C(=O)O)OCCN

InChI

InChI=1S/C15H15NO3S/c16-7-8-19-13-4-2-1-3-11(13)10-5-6-14(20)12(9-10)15(17)18/h1-6,9,20H,7-8,16H2,(H,17,18)