2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methyl-propanedioic acid

Systemtic Name: 2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methyl-propanedioic acid Openeye Name: 2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methyl-propanedioic acid CAS Name: 2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methylpropanedioic acid IUPAC Name: 2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methylpropanedioic acid Traditional Name: 2-[2-[2-adamantylidene-(3-phosphonooxyphenyl)methoxy]ethyl]-2-methyl-malonic acid Formula: C23H29O9P MolecularWeight: 480.444721

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=C1C2CC3CC(C2)CC1C3)C4=CC(=CC=C4)OP(=O)(O)O)(C(=O)O)C(=O)O

Isomeric SMILES

CC(CCOC(=C1C2CC3CC(C2)CC1C3)C4=CC(=CC=C4)OP(=O)(O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C23H29O9P/c1-23(21(24)25,22(26)27)5-6-31-20(15-3-2-4-18(12-15)32-33(28,29)30)19-16-8-13-7-14(10-16)11-17(19)9-13/h2-4,12-14,16-17H,5-11H2,1H3,(H,24,25)(H,26,27)(H2,28,29,30)