ethyl 4-diphenylphosphinothioyl-3-pyrrolidin-1-yl-but-2-enoate

Systemtic Name: ethyl 4-diphenylphosphinothioyl-3-pyrrolidin-1-yl-but-2-enoate Openeye Name: ethyl 4-diphenylphosphinothioyl-3-pyrrolidin-1-yl-but-2-enoate CAS Name: 4-diphenylphosphinothioyl-3-(1-pyrrolidinyl)-2-butenoic acid ethyl ester IUPAC Name: ethyl 4-diphenylphosphinothioyl-3-pyrrolidin-1-ylbut-2-enoate Traditional Name: 4-diphenylthiophosphoryl-3-pyrrolidino-but-2-enoic acid ethyl ester Formula: C22H26NO2PS MolecularWeight: 399.486101

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(CP(=S)(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CCOC(=O)C=C(CP(=S)(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C22H26NO2PS/c1-2-25-22(24)17-19(23-15-9-10-16-23)18-26(27,20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-14,17H,2,9-10,15-16,18H2,1H3