disodium [3-[4,4-di(propan-2-yl)-3-propan-2-yloxy-1,2-dioxetan-3-yl]phenyl] phosphate

Systemtic Name: disodium [3-[4,4-di(propan-2-yl)-3-propan-2-yloxy-1,2-dioxetan-3-yl]phenyl] phosphate Openeye Name: disodium [3-(3-isopropoxy-4,4-diisopropyl-dioxetan-3-yl)phenyl] phosphate CAS Name: disodium [3-[4,4-di(propan-2-yl)-3-propan-2-yloxy-3-dioxetanyl]phenyl] phosphate IUPAC Name: disodium [3-[4,4-di(propan-2-yl)-3-propan-2-yloxydioxetan-3-yl]phenyl] phosphate Traditional Name: disodium [3-(3-isopropoxy-4,4-diisopropyl-dioxetan-3-yl)phenyl] phosphate Formula: C17H25Na2O7P MolecularWeight: 418.329501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(OO1)(C2=CC(=CC=C2)OP(=O)([O-])[O-])OC(C)C)C(C)C.[Na+].[Na+]

Isomeric SMILES

CC(C)C1(C(OO1)(C2=CC(=CC=C2)OP(=O)([O-])[O-])OC(C)C)C(C)C.[Na+].[Na+]

InChI

InChI=1S/C17H27O7P.2Na/c1-11(2)16(12(3)4)17(24-23-16,21-13(5)6)14-8-7-9-15(10-14)22-25(18,19)20;;/h7-13H,1-6H3,(H2,18,19,20);;/q;2*+1/p-2