[4-[9-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]nonyl-methanoyl-amino]phenyl]phosphonic acid

Systemtic Name: [4-[9-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]nonyl-methanoyl-amino]phenyl]phosphonic acid Openeye Name: [4-[9-(4-diethoxyphosphoryl-N-formyl-anilino)nonyl-formyl-amino]phenyl]phosphonic acid CAS Name: [4-[9-(4-diethoxyphosphoryl-N-formylanilino)nonyl-formylamino]phenyl]phosphonic acid IUPAC Name: [4-[9-(4-diethoxyphosphoryl-N-formylanilino)nonyl-formylamino]phenyl]phosphonic acid Traditional Name: [4-[9-(4-diethoxyphosphoryl-N-formyl-anilino)nonyl-formyl-amino]phenyl]phosphonic acid Formula: C27H40N2O8P2 MolecularWeight: 582.562622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(C=C1)N(CCCCCCCCCN(C=O)C2=CC=C(C=C2)P(=O)(O)O)C=O)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(C=C1)N(CCCCCCCCCN(C=O)C2=CC=C(C=C2)P(=O)(O)O)C=O)OCC

InChI

InChI=1S/C27H40N2O8P2/c1-3-36-39(35,37-4-2)27-18-14-25(15-19-27)29(23-31)21-11-9-7-5-6-8-10-20-28(22-30)24-12-16-26(17-13-24)38(32,33)34/h12-19,22-23H,3-11,20-21H2,1-2H3,(H2,32,33,34)