[5-[5-[4-(5-dec-1-ynylthiophen-2-yl)-2-hexoxy-5-methoxy-phenyl]thiophen-2-yl]thiophen-2-yl]phosphonic acid

Systemtic Name: [5-[5-[4-(5-dec-1-ynylthiophen-2-yl)-2-hexoxy-5-methoxy-phenyl]thiophen-2-yl]thiophen-2-yl]phosphonic acid Openeye Name: [5-[5-[4-(5-dec-1-ynyl-2-thienyl)-2-hexoxy-5-methoxy-phenyl]-2-thienyl]-2-thienyl]phosphonic acid CAS Name: [5-[5-[4-(5-dec-1-ynyl-2-thiophenyl)-2-hexoxy-5-methoxyphenyl]-2-thiophenyl]-2-thiophenyl]phosphonic acid IUPAC Name: [5-[5-[4-(5-dec-1-ynylthiophen-2-yl)-2-hexoxy-5-methoxyphenyl]thiophen-2-yl]thiophen-2-yl]phosphonic acid Traditional Name: [5-[5-[4-(5-dec-1-ynyl-2-thienyl)-2-hexoxy-5-methoxy-phenyl]-2-thienyl]-2-thienyl]phosphonic acid Formula: C35H43O5PS3 MolecularWeight: 670.881681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CC1=CC=C(S1)C2=C(C=C(C(=C2)OCCCCCC)C3=CC=C(S3)C4=CC=C(S4)P(=O)(O)O)OC

Isomeric SMILES

CCCCCCCCC#CC1=CC=C(S1)C2=C(C=C(C(=C2)OCCCCCC)C3=CC=C(S3)C4=CC=C(S4)P(=O)(O)O)OC

InChI

InChI=1S/C35H43O5PS3/c1-4-6-8-10-11-12-13-14-16-26-17-18-31(42-26)27-25-30(40-23-15-9-7-5-2)28(24-29(27)39-3)32-19-20-33(43-32)34-21-22-35(44-34)41(36,37)38/h17-22,24-25H,4-13,15,23H2,1-3H3,(H2,36,37,38)