[4-(1-adamantyl)-2,6-dimethoxy-phenyl] ethyl methyl phosphate

Systemtic Name: [4-(1-adamantyl)-2,6-dimethoxy-phenyl] ethyl methyl phosphate Openeye Name: [4-(1-adamantyl)-2,6-dimethoxy-phenyl] ethyl methyl phosphate CAS Name: phosphoric acid [4-(1-adamantyl)-2,6-dimethoxyphenyl] ethyl methyl ester IUPAC Name: [4-(1-adamantyl)-2,6-dimethoxyphenyl] ethyl methyl phosphate Traditional Name: phosphoric acid [4-(1-adamantyl)-2,6-dimethoxy-phenyl] ethyl methyl ester Formula: C21H31O6P MolecularWeight: 410.441001

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OC)OC1=C(C=C(C=C1OC)C23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

CCOP(=O)(OC)OC1=C(C=C(C=C1OC)C23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C21H31O6P/c1-5-26-28(22,25-4)27-20-18(23-2)9-17(10-19(20)24-3)21-11-14-6-15(12-21)8-16(7-14)13-21/h9-10,14-16H,5-8,11-13H2,1-4H3