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

Systemtic Name: [2-azanyl-2-(hydroxymethyl)-4-[4-(4-pentylphenyl)phenyl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-(hydroxymethyl)-4-[4-(4-pentylphenyl)phenyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-(hydroxymethyl)-4-[4-(4-pentylphenyl)phenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-(hydroxymethyl)-4-[4-(4-pentylphenyl)phenyl]butyl] dihydrogen phosphate Traditional Name: [2-amino-4-[4-(4-amylphenyl)phenyl]-2-methylol-butyl] dihydrogen phosphate Formula: C22H32NO5P MolecularWeight: 421.466941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(CO)(COP(=O)(O)O)N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(CO)(COP(=O)(O)O)N

InChI

InChI=1S/C22H32NO5P/c1-2-3-4-5-18-6-10-20(11-7-18)21-12-8-19(9-13-21)14-15-22(23,16-24)17-28-29(25,26)27/h6-13,24H,2-5,14-17,23H2,1H3,(H2,25,26,27)