(2-methoxyphenyl) bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] phosphate

Systemtic Name: (2-methoxyphenyl) bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] phosphate Openeye Name: bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2-methoxyphenyl) phosphate CAS Name: phosphoric acid (2-methoxyphenyl) bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: (2-methoxyphenyl) bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] phosphate Traditional Name: phosphoric acid bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2-methoxyphenyl) ester Formula: C27H45O5P MolecularWeight: 480.616961

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(OC2CC(CCC2C(C)C)C)OC3=CC=CC=C3OC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OP(=O)(O[C@@H]2C[C@@H](CC[C@H]2C(C)C)C)OC3=CC=CC=C3OC)C(C)C

InChI

InChI=1S/C27H45O5P/c1-18(2)22-14-12-20(5)16-26(22)31-33(28,30-25-11-9-8-10-24(25)29-7)32-27-17-21(6)13-15-23(27)19(3)4/h8-11,18-23,26-27H,12-17H2,1-7H3/t20-,21-,22+,23+,26-,27-/m1/s1