butan-1-amine; 2-(1-iodanylethyl)hexyl phosphate

Systemtic Name: butan-1-amine; 2-(1-iodanylethyl)hexyl phosphate Openeye Name: butan-1-amine; 2-(1-iodoethyl)hexyl phosphate CAS Name: 1-butanamine; 2-(1-iodoethyl)hexyl phosphate IUPAC Name: butan-1-amine; 2-(1-iodoethyl)hexyl phosphate Traditional Name: butylamine; 2-(1-iodoethyl)hexyl phosphate Formula: C12H27INO4P-2 MolecularWeight: 407.225311

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(COP(=O)([O-])[O-])C(C)I.CCCCN

Isomeric SMILES

CCCCC(COP(=O)([O-])[O-])C(C)I.CCCCN

InChI

InChI=1S/C8H18IO4P.C4H11N/c1-3-4-5-8(7(2)9)6-13-14(10,11)12;1-2-3-4-5/h7-8H,3-6H2,1-2H3,(H2,10,11,12);2-5H2,1H3/p-2