ethoxy-(2-pyridazin-3-yl-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)phosphinic acid

Systemtic Name: ethoxy-(2-pyridazin-3-yl-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)phosphinic acid Openeye Name: ethoxy-(2-pyridazin-3-yl-3-thioxo-cyclohexa-1,5-dien-1-yl)phosphinic acid CAS Name: ethoxy-[2-(3-pyridazinyl)-3-sulfanylidene-1-cyclohexa-1,5-dienyl]phosphinic acid IUPAC Name: ethoxy-(2-pyridazin-3-yl-3-sulfanylidenecyclohexa-1,5-dien-1-yl)phosphinic acid Traditional Name: ethoxy-(2-pyridazin-3-yl-3-thioxo-cyclohexa-1,5-dien-1-yl)phosphinic acid Formula: C12H13N2O3PS MolecularWeight: 296.281981

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(C(=S)CC=C1)C2=NN=CC=C2)O

Isomeric SMILES

CCOP(=O)(C1=C(C(=S)CC=C1)C2=NN=CC=C2)O

InChI

InChI=1S/C12H13N2O3PS/c1-2-17-18(15,16)10-6-3-7-11(19)12(10)9-5-4-8-13-14-9/h3-6,8H,2,7H2,1H3,(H,15,16)