[5-[5-[[(4-acetamidophenyl)amino]methyl]-2-methoxy-phenyl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[5-[[(4-acetamidophenyl)amino]methyl]-2-methoxy-phenyl]furan-2-yl]phosphonic acid Openeye Name: [5-[5-[(4-acetamidoanilino)methyl]-2-methoxy-phenyl]-2-furyl]phosphonic acid CAS Name: [5-[5-[(4-acetamidoanilino)methyl]-2-methoxyphenyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[5-[(4-acetamidoanilino)methyl]-2-methoxyphenyl]furan-2-yl]phosphonic acid Traditional Name: [5-[5-[(4-acetamidoanilino)methyl]-2-methoxy-phenyl]-2-furyl]phosphonic acid Formula: C20H21N2O6P MolecularWeight: 416.364301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NCC2=CC(=C(C=C2)OC)C3=CC=C(O3)P(=O)(O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NCC2=CC(=C(C=C2)OC)C3=CC=C(O3)P(=O)(O)O

InChI

InChI=1S/C20H21N2O6P/c1-13(23)22-16-6-4-15(5-7-16)21-12-14-3-8-18(27-2)17(11-14)19-9-10-20(28-19)29(24,25)26/h3-11,21H,12H2,1-2H3,(H,22,23)(H2,24,25,26)