diethyl 3-(diphenylphosphinothioylmethyl)-4-methyl-cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl 3-(diphenylphosphinothioylmethyl)-4-methyl-cyclopentane-1,1-dicarboxylate Openeye Name: diethyl 3-(diphenylphosphinothioylmethyl)-4-methyl-cyclopentane-1,1-dicarboxylate CAS Name: 3-(diphenylphosphinothioylmethyl)-4-methylcyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(diphenylphosphinothioylmethyl)-4-methylcyclopentane-1,1-dicarboxylate Traditional Name: 3-(diphenylthiophosphorylmethyl)-4-methyl-cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C25H31O4PS MolecularWeight: 458.550001

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(C1)CP(=S)(C2=CC=CC=C2)C3=CC=CC=C3)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(C(C1)CP(=S)(C2=CC=CC=C2)C3=CC=CC=C3)C)C(=O)OCC

InChI

InChI=1S/C25H31O4PS/c1-4-28-23(26)25(24(27)29-5-2)16-19(3)20(17-25)18-30(31,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-15,19-20H,4-5,16-18H2,1-3H3