ethyl 4-ethoxycarbonylsulfanyl-2-(triphenyl-$l^{5}-phosphanylidene)butanoate

Systemtic Name: ethyl 4-ethoxycarbonylsulfanyl-2-(triphenyl-$l^{5}-phosphanylidene)butanoate Openeye Name: ethyl 4-ethoxycarbonylsulfanyl-2-(triphenyl-$l^{5}-phosphanylidene)butanoate CAS Name: 4-(ethoxycarbonylthio)-2-triphenylphosphoranylidenebutanoic acid ethyl ester IUPAC Name: ethyl 4-ethoxycarbonylsulfanyl-2-(triphenyl-$l^{5}-phosphanylidene)butanoate Traditional Name: 4-(carbethoxythio)-2-triphenylphosphoranylidene-butyric acid ethyl ester Formula: C27H29O4PS MolecularWeight: 480.555521

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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)CCSC(=O)OCC

Isomeric SMILES

CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)CCSC(=O)OCC

InChI

InChI=1S/C27H29O4PS/c1-3-30-26(28)25(20-21-33-27(29)31-4-2)32(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19H,3-4,20-21H2,1-2H3