[2-(5-phosphono-3,4-dithiophen-2-yl-thiophen-2-yl)thiophen-3-yl]phosphonic acid

Systemtic Name: [2-(5-phosphono-3,4-dithiophen-2-yl-thiophen-2-yl)thiophen-3-yl]phosphonic acid Openeye Name: [2-[5-phosphono-3,4-bis(2-thienyl)-2-thienyl]-3-thienyl]phosphonic acid CAS Name: [2-(5-phosphono-3,4-dithiophen-2-yl-2-thiophenyl)-3-thiophenyl]phosphonic acid IUPAC Name: [2-(5-phosphono-3,4-dithiophen-2-ylthiophen-2-yl)thiophen-3-yl]phosphonic acid Traditional Name: [2-[5-phosphono-3,4-bis(2-thienyl)-2-thienyl]-3-thienyl]phosphonic acid Formula: C16H12O6P2S4 MolecularWeight: 490.470402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(SC(=C2C3=CC=CS3)P(=O)(O)O)C4=C(C=CS4)P(=O)(O)O

Isomeric SMILES

C1=CSC(=C1)C2=C(SC(=C2C3=CC=CS3)P(=O)(O)O)C4=C(C=CS4)P(=O)(O)O

InChI

InChI=1S/C16H12O6P2S4/c17-23(18,19)9-5-8-27-14(9)15-12(10-3-1-6-25-10)13(11-4-2-7-26-11)16(28-15)24(20,21)22/h1-8H,(H2,17,18,19)(H2,20,21,22)