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

Systemtic Name: methyl 2-[4-[4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazin-1-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenyl-acetate CAS Name: 2-[4-[4-[[(2-iodophenyl)-oxomethyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazin-1-yl]-2-phenylacetate Traditional Name: 2-[4-[4-[(2-iodobenzoyl)amino]phenyl]piperazino]-2-phenyl-acetic acid methyl ester Formula: C26H26IN3O3 MolecularWeight: 555.40741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26IN3O3/c1-33-26(32)24(19-7-3-2-4-8-19)30-17-15-29(16-18-30)21-13-11-20(12-14-21)28-25(31)22-9-5-6-10-23(22)27/h2-14,24H,15-18H2,1H3,(H,28,31)