2-ethylhexan-1-amine; 6-methylheptyl hydrogen phosphate

Systemtic Name: 2-ethylhexan-1-amine; 6-methylheptyl hydrogen phosphate Openeye Name: 2-ethylhexan-1-amine; 6-methylheptyl hydrogen phosphate CAS Name: 2-ethyl-1-hexanamine; 6-methylheptyl hydrogen phosphate IUPAC Name: 2-ethylhexan-1-amine; 6-methylheptyl hydrogen phosphate Traditional Name: 2-ethylhexylamine; 6-methylheptyl hydrogen phosphate Formula: C16H37NO4P- MolecularWeight: 338.443041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN.CC(C)CCCCCOP(=O)(O)[O-]

Isomeric SMILES

CCCCC(CC)CN.CC(C)CCCCCOP(=O)(O)[O-]

InChI

InChI=1S/C8H19N.C8H19O4P/c1-3-5-6-8(4-2)7-9;1-8(2)6-4-3-5-7-12-13(9,10)11/h8H,3-7,9H2,1-2H3;8H,3-7H2,1-2H3,(H2,9,10,11)/p-1