4-[4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[4-[(2-iodanylphenyl)carbonylamino]phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[4-[(2-iodobenzoyl)amino]phenyl]piperazine-1-carboxylic acid CAS Name: 4-[4-[[(2-iodophenyl)-oxomethyl]amino]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[4-[(2-iodobenzoyl)amino]phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[4-[(2-iodobenzoyl)amino]phenyl]piperazine-1-carboxylic acid Formula: C18H18IN3O3 MolecularWeight: 451.25829

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18IN3O3/c19-16-4-2-1-3-15(16)17(23)20-13-5-7-14(8-6-13)21-9-11-22(12-10-21)18(24)25/h1-8H,9-12H2,(H,20,23)(H,24,25)