[4-[12-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]dodecyl-methanoyl-amino]phenyl]phosphonic acid

Systemtic Name: [4-[12-[(4-diethoxyphosphorylphenyl)-methanoyl-amino]dodecyl-methanoyl-amino]phenyl]phosphonic acid Openeye Name: [4-[12-(4-diethoxyphosphoryl-N-formyl-anilino)dodecyl-formyl-amino]phenyl]phosphonic acid CAS Name: [4-[12-(4-diethoxyphosphoryl-N-formylanilino)dodecyl-formylamino]phenyl]phosphonic acid IUPAC Name: [4-[12-(4-diethoxyphosphoryl-N-formylanilino)dodecyl-formylamino]phenyl]phosphonic acid Traditional Name: [4-[12-(4-diethoxyphosphoryl-N-formyl-anilino)dodecyl-formyl-amino]phenyl]phosphonic acid Formula: C30H46N2O8P2 MolecularWeight: 624.642362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H46N2O8P2/c1-3-39-42(38,40-4-2)30-21-17-28(18-22-30)32(26-34)24-14-12-10-8-6-5-7-9-11-13-23-31(25-33)27-15-19-29(20-16-27)41(35,36)37/h15-22,25-26H,3-14,23-24H2,1-2H3,(H2,35,36,37)