disodium [2,2,7,8-tetramethyl-5-(3-methylbutyl)-3,4-dihydrochromen-6-yl]oxymethyl phosphate

Systemtic Name: disodium [2,2,7,8-tetramethyl-5-(3-methylbutyl)-3,4-dihydrochromen-6-yl]oxymethyl phosphate Openeye Name: disodium (5-isopentyl-2,2,7,8-tetramethyl-chroman-6-yl)oxymethyl phosphate CAS Name: disodium [2,2,7,8-tetramethyl-5-(3-methylbutyl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxymethyl phosphate IUPAC Name: disodium [2,2,7,8-tetramethyl-5-(3-methylbutyl)-3,4-dihydrochromen-6-yl]oxymethyl phosphate Traditional Name: disodium (5-isoamyl-2,2,7,8-tetramethyl-chroman-6-yl)oxymethyl phosphate Formula: C19H29Na2O6P MolecularWeight: 430.383261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OCOP(=O)([O-])[O-])CCC(C)C)CCC(O2)(C)C.[Na+].[Na+]

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OCOP(=O)([O-])[O-])CCC(C)C)CCC(O2)(C)C.[Na+].[Na+]

InChI

InChI=1S/C19H31O6P.2Na/c1-12(2)7-8-15-16-9-10-19(5,6)25-18(16)14(4)13(3)17(15)23-11-24-26(20,21)22;;/h12H,7-11H2,1-6H3,(H2,20,21,22);;/q;2*+1/p-2