2-bromanyl-5-piperazin-1-yl-benzoic acid

Systemtic Name: 2-bromanyl-5-piperazin-1-yl-benzoic acid Openeye Name: 2-bromo-5-piperazin-1-yl-benzoic acid CAS Name: 2-bromo-5-(1-piperazinyl)benzoic acid IUPAC Name: 2-bromo-5-piperazin-1-ylbenzoic acid Traditional Name: 2-bromo-5-piperazino-benzoic acid Formula: C11H13BrN2O2 MolecularWeight: 285.13712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C11H13BrN2O2/c12-10-2-1-8(7-9(10)11(15)16)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2,(H,15,16)