[(4-ethoxycarbonyl-1,3-thiazol-2-yl)-methoxy-methyl]-triphenyl-phosphanium bromide

Systemtic Name: [(4-ethoxycarbonyl-1,3-thiazol-2-yl)-methoxy-methyl]-triphenyl-phosphanium bromide Openeye Name: [(4-ethoxycarbonylthiazol-2-yl)-methoxy-methyl]-triphenyl-phosphonium bromide CAS Name: [(4-ethoxycarbonyl-2-thiazolyl)-methoxymethyl]-triphenylphosphonium bromide IUPAC Name: [(4-ethoxycarbonyl-1,3-thiazol-2-yl)-methoxymethyl]-triphenylphosphanium bromide Traditional Name: [(4-carbethoxythiazol-2-yl)-methoxy-methyl]-triphenyl-phosphonium bromide Formula: C26H25BrNO3PS MolecularWeight: 542.424361

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C(OC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C(OC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C26H25NO3PS.BrH/c1-3-30-25(28)23-19-32-24(27-23)26(29-2)31(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-19,26H,3H2,1-2H3;1H/q+1;/p-1