[4-azanyl-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid

Systemtic Name: [4-azanyl-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid Openeye Name: [4-amino-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid CAS Name: [4-amino-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid IUPAC Name: [4-amino-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid Traditional Name: [4-amino-4-methyl-6-(4-octylphenyl)hexyl]phosphonic acid Formula: C21H38NO3P MolecularWeight: 383.505081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(C)(CCCP(=O)(O)O)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(C)(CCCP(=O)(O)O)N

InChI

InChI=1S/C21H38NO3P/c1-3-4-5-6-7-8-10-19-11-13-20(14-12-19)15-17-21(2,22)16-9-18-26(23,24)25/h11-14H,3-10,15-18,22H2,1-2H3,(H2,23,24,25)