cyclohexanamine; phenethyl dihydrogen phosphate

Systemtic Name: cyclohexanamine; phenethyl dihydrogen phosphate Openeye Name: cyclohexanamine; phenethyl dihydrogen phosphate CAS Name: cyclohexanamine; phenethyl dihydrogen phosphate IUPAC Name: cyclohexanamine; phenethyl dihydrogen phosphate Traditional Name: cyclohexylamine; phenethyl dihydrogen phosphate Formula: C20H37N2O4P MolecularWeight: 406.491822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N.C1CCC(CC1)N.C1=CC=C(C=C1)CCOP(=O)(O)O

Isomeric SMILES

C1CCC(CC1)N.C1CCC(CC1)N.C1=CC=C(C=C1)CCOP(=[18O])([18OH])[18OH]

InChI

InChI=1S/C8H11O4P.2C6H13N/c9-13(10,11)12-7-6-8-4-2-1-3-5-8;2*7-6-4-2-1-3-5-6/h1-5H,6-7H2,(H2,9,10,11);2*6H,1-5,7H2/i9+2,10+2,11+2;;