[2-azanyl-4-[4-(3-cyclohexylpropoxy)phenyl]-2-(hydroxymethyl)butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-4-[4-(3-cyclohexylpropoxy)phenyl]-2-(hydroxymethyl)butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[4-(3-cyclohexylpropoxy)phenyl]-2-(hydroxymethyl)butyl] dihydrogen phosphate CAS Name: [2-amino-4-[4-(3-cyclohexylpropoxy)phenyl]-2-(hydroxymethyl)butyl] dihydrogen phosphate IUPAC Name: [2-amino-4-[4-(3-cyclohexylpropoxy)phenyl]-2-(hydroxymethyl)butyl] dihydrogen phosphate Traditional Name: [2-amino-4-[4-(3-cyclohexylpropoxy)phenyl]-2-methylol-butyl] dihydrogen phosphate Formula: C20H34NO6P MolecularWeight: 415.460821

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCOC2=CC=C(C=C2)CCC(CO)(COP(=O)(O)O)N

Isomeric SMILES

C1CCC(CC1)CCCOC2=CC=C(C=C2)CCC(CO)(COP(=O)(O)O)N

InChI

InChI=1S/C20H34NO6P/c21-20(15-22,16-27-28(23,24)25)13-12-18-8-10-19(11-9-18)26-14-4-7-17-5-2-1-3-6-17/h8-11,17,22H,1-7,12-16,21H2,(H2,23,24,25)