ethyl (E)-7-(2-bromophenyl)-5-methyl-3-oxidanylidene-2-(triphenyl-$l^{5}-phosphanylidene)hept-4-enoate

Systemtic Name: ethyl (E)-7-(2-bromophenyl)-5-methyl-3-oxidanylidene-2-(triphenyl-$l^{5}-phosphanylidene)hept-4-enoate Openeye Name: ethyl (E)-7-(2-bromophenyl)-5-methyl-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)hept-4-enoate CAS Name: (E)-7-(2-bromophenyl)-5-methyl-3-oxo-2-triphenylphosphoranylidene-4-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(2-bromophenyl)-5-methyl-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)hept-4-enoate Traditional Name: (E)-7-(2-bromophenyl)-3-keto-5-methyl-2-triphenylphosphoranylidene-hept-4-enoic acid ethyl ester Formula: C34H32BrO3P MolecularWeight: 599.493841

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C=C(C)CCC4=CC=CC=C4Br

Isomeric SMILES

CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)/C=C(\C)/CCC4=CC=CC=C4Br

InChI

InChI=1S/C34H32BrO3P/c1-3-38-34(37)33(32(36)25-26(2)23-24-27-15-13-14-22-31(27)35)39(28-16-7-4-8-17-28,29-18-9-5-10-19-29)30-20-11-6-12-21-30/h4-22,25H,3,23-24H2,1-2H3/b26-25+