(2-butan-2-yl-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)phosphonic acid

Systemtic Name: (2-butan-2-yl-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)phosphonic acid Openeye Name: (2-sec-butyl-3-thioxo-cyclohexa-1,5-dien-1-yl)phosphonic acid CAS Name: (2-butan-2-yl-3-sulfanylidene-1-cyclohexa-1,5-dienyl)phosphonic acid IUPAC Name: (2-butan-2-yl-3-sulfanylidenecyclohexa-1,5-dien-1-yl)phosphonic acid Traditional Name: (2-sec-butyl-3-thioxo-cyclohexa-1,5-dien-1-yl)phosphonic acid Formula: C10H15O3PS MolecularWeight: 246.263061

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CCC1=S)P(=O)(O)O

Isomeric SMILES

CCC(C)C1=C(C=CCC1=S)P(=O)(O)O

InChI

InChI=1S/C10H15O3PS/c1-3-7(2)10-8(14(11,12)13)5-4-6-9(10)15/h4-5,7H,3,6H2,1-2H3,(H2,11,12,13)