2-[4-[4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazin-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazin-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenyl-acetic acid CAS Name: 2-[4-[4-[[(2-iodophenyl)-oxomethyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid IUPAC Name: 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenylacetic acid Traditional Name: 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazino]-2-phenyl-acetic acid Formula: C25H24IN3O3 MolecularWeight: 541.38083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I)C(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I)C(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H24IN3O3/c26-22-9-5-4-8-21(22)24(30)27-19-10-12-20(13-11-19)28-14-16-29(17-15-28)23(25(31)32)18-6-2-1-3-7-18/h1-13,23H,14-17H2,(H,27,30)(H,31,32)