ethyl 4-[2-[(3-iodanylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(3-iodanylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(3-iodobenzoyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[(3-iodophenyl)-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(3-iodobenzoyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(3-iodobenzoyl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H22IN3O4 MolecularWeight: 507.32155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)I

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C21H22IN3O4/c1-2-29-21(28)25-12-10-24(11-13-25)20(27)17-8-3-4-9-18(17)23-19(26)15-6-5-7-16(22)14-15/h3-9,14H,2,10-13H2,1H3,(H,23,26)