2-(3-sulfanylidene-1H-benzo[de]isoquinolin-2-yl)ethanoic acid

Systemtic Name: 2-(3-sulfanylidene-1H-benzo[de]isoquinolin-2-yl)ethanoic acid Openeye Name: 2-(3-thioxo-1H-benzo[de]isoquinolin-2-yl)acetic acid CAS Name: 2-(3-sulfanylidene-1H-benzo[de]isoquinolin-2-yl)acetic acid IUPAC Name: 2-(3-sulfanylidene-1H-benzo[de]isoquinolin-2-yl)acetic acid Traditional Name: 2-(3-thioxo-1H-benzo[de]isoquinolin-2-yl)acetic acid Formula: C14H11NO2S MolecularWeight: 257.30764

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC3=C2C(=CC=C3)C(=S)N1CC(=O)O

Isomeric SMILES

C1C2=CC=CC3=C2C(=CC=C3)C(=S)N1CC(=O)O

InChI

InChI=1S/C14H11NO2S/c16-12(17)8-15-7-10-5-1-3-9-4-2-6-11(13(9)10)14(15)18/h1-6H,7-8H2,(H,16,17)