2-[(2-sulfanylidene-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]ethanoic acid

Systemtic Name: 2-[(2-sulfanylidene-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]ethanoic acid Openeye Name: 2-[(2-thioxo-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]acetic acid CAS Name: 2-[(2-sulfanylidene-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]acetic acid IUPAC Name: 2-[(2-sulfanylidene-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]acetic acid Traditional Name: 2-[(2-thioxo-4,5-dihydro-1H-benzo[e][1,3]benzothiazol-7-yl)oxy]acetic acid Formula: C13H11NO3S2 MolecularWeight: 293.36134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=C(C=C3)OCC(=O)O)NC(=S)S2

Isomeric SMILES

C1CC2=C(C3=C1C=C(C=C3)OCC(=O)O)NC(=S)S2

InChI

InChI=1S/C13H11NO3S2/c15-11(16)6-17-8-2-3-9-7(5-8)1-4-10-12(9)14-13(18)19-10/h2-3,5H,1,4,6H2,(H,14,18)(H,15,16)