[(3R,4R)-2,4-dimethyl-6-piperidin-1-yl-hexan-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(3R,4R)-2,4-dimethyl-6-piperidin-1-yl-hexan-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [(1R,2R)-1-isopropyl-2-methyl-4-(1-piperidyl)butyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(3R,4R)-2,4-dimethyl-6-(1-piperidinyl)hexan-3-yl] ester IUPAC Name: [(3R,4R)-2,4-dimethyl-6-piperidin-1-ylhexan-3-yl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(1R,2R)-1-isopropyl-2-methyl-4-piperidino-butyl] ester Formula: C32H40NO2P MolecularWeight: 501.639261

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)CCN1CCCCC1)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CCN1CCCCC1)[C@@H](C(C)C)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H40NO2P/c1-25(2)31(26(3)21-24-33-22-13-6-14-23-33)35-32(34)29-19-11-12-20-30(29)36(27-15-7-4-8-16-27)28-17-9-5-10-18-28/h4-5,7-12,15-20,25-26,31H,6,13-14,21-24H2,1-3H3/t26-,31-/m1/s1