3-[(4-octylphenyl)methylamino]propylphosphonic acid

Systemtic Name: 3-[(4-octylphenyl)methylamino]propylphosphonic acid Openeye Name: 3-[(4-octylphenyl)methylamino]propylphosphonic acid CAS Name: 3-[(4-octylphenyl)methylamino]propylphosphonic acid IUPAC Name: 3-[(4-octylphenyl)methylamino]propylphosphonic acid Traditional Name: 3-[(4-octylbenzyl)amino]propylphosphonic acid Formula: C18H32NO3P MolecularWeight: 341.425341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CNCCCP(=O)(O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CNCCCP(=O)(O)O

InChI

InChI=1S/C18H32NO3P/c1-2-3-4-5-6-7-9-17-10-12-18(13-11-17)16-19-14-8-15-23(20,21)22/h10-13,19H,2-9,14-16H2,1H3,(H2,20,21,22)