[2,3-bis(bromanyl)-1,4-diethoxy-1,4-bis(oxidanylidene)-3-(10-oxidanylphenanthren-9-yl)butan-2-yl]-triphenyl-phosphanium

Systemtic Name: [2,3-bis(bromanyl)-1,4-diethoxy-1,4-bis(oxidanylidene)-3-(10-oxidanylphenanthren-9-yl)butan-2-yl]-triphenyl-phosphanium Openeye Name: [1,2-dibromo-3-ethoxy-1-ethoxycarbonyl-2-(10-hydroxy-9-phenanthryl)-3-oxo-propyl]-triphenyl-phosphonium CAS Name: [2,3-dibromo-1,4-diethoxy-3-(10-hydroxy-9-phenanthrenyl)-1,4-dioxobutan-2-yl]-triphenylphosphonium IUPAC Name: [2,3-dibromo-1,4-diethoxy-3-(10-hydroxyphenanthren-9-yl)-1,4-dioxobutan-2-yl]-triphenylphosphanium Traditional Name: [1,2-dibromo-1-carbethoxy-3-ethoxy-2-(10-hydroxy-9-phenanthryl)-3-keto-propyl]-triphenyl-phosphonium Formula: C40H34Br2O5P+ MolecularWeight: 785.476721

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C2=CC=CC=C2C3=CC=CC=C31)O)(C(C(=O)OCC)([P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)Br)Br

Isomeric SMILES

CCOC(=O)C(C1=C(C2=CC=CC=C2C3=CC=CC=C31)O)(C(C(=O)OCC)([P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)Br)Br

InChI

InChI=1S/C40H33Br2O5P/c1-3-46-37(44)39(41,35-33-26-16-14-24-31(33)32-25-15-17-27-34(32)36(35)43)40(42,38(45)47-4-2)48(28-18-8-5-9-19-28,29-20-10-6-11-21-29)30-22-12-7-13-23-30/h5-27H,3-4H2,1-2H3/p+1