[3-[4-(2-adamantyl)-3-methoxy-1,2-dioxetan-3-yl]phenyl] dihydrogen phosphate

Systemtic Name: [3-[4-(2-adamantyl)-3-methoxy-1,2-dioxetan-3-yl]phenyl] dihydrogen phosphate Openeye Name: [3-[4-(2-adamantyl)-3-methoxy-dioxetan-3-yl]phenyl] dihydrogen phosphate CAS Name: [3-[4-(2-adamantyl)-3-methoxy-3-dioxetanyl]phenyl] dihydrogen phosphate IUPAC Name: [3-[4-(2-adamantyl)-3-methoxydioxetan-3-yl]phenyl] dihydrogen phosphate Traditional Name: [3-[4-(2-adamantyl)-3-methoxy-dioxetan-3-yl]phenyl] dihydrogen phosphate Formula: C19H25O7P MolecularWeight: 396.371361

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(OO1)C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)OP(=O)(O)O

Isomeric SMILES

COC1(C(OO1)C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)OP(=O)(O)O

InChI

InChI=1S/C19H25O7P/c1-23-19(15-3-2-4-16(10-15)25-27(20,21)22)18(24-26-19)17-13-6-11-5-12(8-13)9-14(17)7-11/h2-4,10-14,17-18H,5-9H2,1H3,(H2,20,21,22)