[[2-(benzotriazol-1-yl)-4-[2-(4-methoxycarbonylphenyl)ethyl]phenyl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[2-(benzotriazol-1-yl)-4-[2-(4-methoxycarbonylphenyl)ethyl]phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[2-(benzotriazol-1-yl)-4-[2-(4-methoxycarbonylphenyl)ethyl]phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[2-(1-benzotriazolyl)-4-[2-(4-methoxycarbonylphenyl)ethyl]phenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[2-(benzotriazol-1-yl)-4-[2-(4-methoxycarbonylphenyl)ethyl]phenyl]-difluoromethyl]phosphonic acid Traditional Name: [[2-(benzotriazol-1-yl)-4-[2-(4-carbomethoxyphenyl)ethyl]phenyl]-difluoro-methyl]phosphonic acid Formula: C23H20F2N3O5P MolecularWeight: 487.392567

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC2=CC(=C(C=C2)C(F)(F)P(=O)(O)O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCC2=CC(=C(C=C2)C(F)(F)P(=O)(O)O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H20F2N3O5P/c1-33-22(29)17-11-8-15(9-12-17)6-7-16-10-13-18(23(24,25)34(30,31)32)21(14-16)28-20-5-3-2-4-19(20)26-27-28/h2-5,8-14H,6-7H2,1H3,(H2,30,31,32)