methyl 2-[4-[2-fluoranyl-4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazin-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-[2-fluoranyl-4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazin-1-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-[2-fluoro-4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenyl-acetate CAS Name: 2-[4-[2-fluoro-4-[[(2-iodophenyl)-oxomethyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-[2-fluoro-4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenylacetate Traditional Name: 2-[4-[2-fluoro-4-[(2-iodobenzoyl)amino]phenyl]piperazino]-2-phenyl-acetic acid methyl ester Formula: C26H25FIN3O3 MolecularWeight: 573.397873

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4I)F

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4I)F

InChI

InChI=1S/C26H25FIN3O3/c1-34-26(33)24(18-7-3-2-4-8-18)31-15-13-30(14-16-31)23-12-11-19(17-21(23)27)29-25(32)20-9-5-6-10-22(20)28/h2-12,17,24H,13-16H2,1H3,(H,29,32)