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SMILES: [nH]1nc(c2cccc(c12)Br)C(=O)O Canonical SMILES: OC(=O)c1n[nH]c2c1cccc2Br InChI: InChI=1S/C8H5BrN2O2/c9-5-3-1-2-4-6(5)10-11-7(4)8(12)13/h1-3H,(H,10,11)(H,12,13) InChIKey: HJSGTNVPWFFHOJ-UHFFFAOYSA-N
CBID:68342 http://www.chembase.cn/molecule-68342.html