[4-[11-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]undecyl-methanoyl-amino]phenyl]phosphonic acid

Systemtic Name: [4-[11-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]undecyl-methanoyl-amino]phenyl]phosphonic acid Openeye Name: [4-[11-(4-diethoxyphosphoryl-N-formyl-anilino)undecyl-formyl-amino]phenyl]phosphonic acid CAS Name: [4-[11-(4-diethoxyphosphoryl-N-formylanilino)undecyl-formylamino]phenyl]phosphonic acid IUPAC Name: [4-[11-(4-diethoxyphosphoryl-N-formylanilino)undecyl-formylamino]phenyl]phosphonic acid Traditional Name: [4-[11-(4-diethoxyphosphoryl-N-formyl-anilino)undecyl-formyl-amino]phenyl]phosphonic acid Formula: C29H44N2O8P2 MolecularWeight: 610.615782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H44N2O8P2/c1-3-38-41(37,39-4-2)29-20-16-27(17-21-29)31(25-33)23-13-11-9-7-5-6-8-10-12-22-30(24-32)26-14-18-28(19-15-26)40(34,35)36/h14-21,24-25H,3-13,22-23H2,1-2H3,(H2,34,35,36)