3-iodanyl-4-piperazin-1-yl-benzoic acid

Systemtic Name: 3-iodanyl-4-piperazin-1-yl-benzoic acid Openeye Name: 3-iodo-4-piperazin-1-yl-benzoic acid CAS Name: 3-iodo-4-(1-piperazinyl)benzoic acid IUPAC Name: 3-iodo-4-piperazin-1-ylbenzoic acid Traditional Name: 3-iodo-4-piperazino-benzoic acid Formula: C11H13IN2O2 MolecularWeight: 332.13759

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)I

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)I

InChI

InChI=1S/C11H13IN2O2/c12-9-7-8(11(15)16)1-2-10(9)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2,(H,15,16)