1-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenyl-phosphoryl]propan-2-yl ethanoate

Systemtic Name: 1-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenyl-phosphoryl]propan-2-yl ethanoate Openeye Name: [2-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-phenyl-phosphoryl]-1-methyl-ethyl] acetate CAS Name: acetic acid 1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylphosphoryl]propan-2-yl ester IUPAC Name: 1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylphosphoryl]propan-2-yl acetate Traditional Name: acetic acid [2-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-phenyl-phosphoryl]-1-methyl-ethyl] ester Formula: C21H33O4P MolecularWeight: 380.458081

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(CC(C)OC(=O)C)C2=CC=CC=C2)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[P@@](=O)(CC(C)OC(=O)C)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H33O4P/c1-15(2)20-12-11-16(3)13-21(20)25-26(23,14-17(4)24-18(5)22)19-9-7-6-8-10-19/h6-10,15-17,20-21H,11-14H2,1-5H3/t16-,17?,20+,21-,26+/m1/s1