[5-[(4-ethylsulfanylphenyl)methyl]thiophen-2-yl]carbonylphosphonic acid

Systemtic Name: [5-[(4-ethylsulfanylphenyl)methyl]thiophen-2-yl]carbonylphosphonic acid Openeye Name: [5-[(4-ethylsulfanylphenyl)methyl]thiophene-2-carbonyl]phosphonic acid CAS Name: [[5-[[4-(ethylthio)phenyl]methyl]-2-thiophenyl]-oxomethyl]phosphonic acid IUPAC Name: [5-[(4-ethylsulfanylphenyl)methyl]thiophene-2-carbonyl]phosphonic acid Traditional Name: [5-[4-(ethylthio)benzyl]thiophene-2-carbonyl]phosphonic acid Formula: C14H15O4PS2 MolecularWeight: 342.370261

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CC2=CC=C(S2)C(=O)P(=O)(O)O

Isomeric SMILES

CCSC1=CC=C(C=C1)CC2=CC=C(S2)C(=O)P(=O)(O)O

InChI

InChI=1S/C14H15O4PS2/c1-2-20-11-5-3-10(4-6-11)9-12-7-8-13(21-12)14(15)19(16,17)18/h3-8H,2,9H2,1H3,(H2,16,17,18)