[3-azanyl-5-(4-octylphenyl)-2-oxidanyl-pentyl]phosphonic acid

Systemtic Name: [3-azanyl-5-(4-octylphenyl)-2-oxidanyl-pentyl]phosphonic acid Openeye Name: [3-amino-2-hydroxy-5-(4-octylphenyl)pentyl]phosphonic acid CAS Name: [3-amino-2-hydroxy-5-(4-octylphenyl)pentyl]phosphonic acid IUPAC Name: [3-amino-2-hydroxy-5-(4-octylphenyl)pentyl]phosphonic acid Traditional Name: [3-amino-2-hydroxy-5-(4-octylphenyl)pentyl]phosphonic acid Formula: C19H34NO4P MolecularWeight: 371.451321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H34NO4P/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)13-14-18(20)19(21)15-25(22,23)24/h9-12,18-19,21H,2-8,13-15,20H2,1H3,(H2,22,23,24)