[2-[(3,4-dichlorophenyl)amino]-1-phosphono-2-sulfanylidene-ethyl]phosphonic acid

Systemtic Name: [2-[(3,4-dichlorophenyl)amino]-1-phosphono-2-sulfanylidene-ethyl]phosphonic acid Openeye Name: [2-(3,4-dichloroanilino)-1-phosphono-2-thioxo-ethyl]phosphonic acid CAS Name: [2-(3,4-dichloroanilino)-1-phosphono-2-sulfanylideneethyl]phosphonic acid IUPAC Name: [2-(3,4-dichloroanilino)-1-phosphono-2-sulfanylideneethyl]phosphonic acid Traditional Name: [2-(3,4-dichloroanilino)-1-phosphono-2-thioxo-ethyl]phosphonic acid Formula: C8H9Cl2NO6P2S MolecularWeight: 380.078682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=S)C(P(=O)(O)O)P(=O)(O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=S)C(P(=O)(O)O)P(=O)(O)O)Cl)Cl

InChI

InChI=1S/C8H9Cl2NO6P2S/c9-5-2-1-4(3-6(5)10)11-7(20)8(18(12,13)14)19(15,16)17/h1-3,8H,(H,11,20)(H2,12,13,14)(H2,15,16,17)