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

Systemtic Name: 3-[(4-heptoxycarbonylphenyl)methylamino]propylphosphonic acid Openeye Name: 3-[(4-heptoxycarbonylphenyl)methylamino]propylphosphonic acid CAS Name: 3-[[4-[heptoxy(oxo)methyl]phenyl]methylamino]propylphosphonic acid IUPAC Name: 3-[(4-heptoxycarbonylphenyl)methylamino]propylphosphonic acid Traditional Name: 3-[(4-heptoxycarbonylbenzyl)amino]propylphosphonic acid Formula: C18H30NO5P MolecularWeight: 371.408261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30NO5P/c1-2-3-4-5-6-13-24-18(20)17-10-8-16(9-11-17)15-19-12-7-14-25(21,22)23/h8-11,19H,2-7,12-15H2,1H3,(H2,21,22,23)