4-azanyl-3-bromanyl-5-methoxycarbonyl-benzoic acid

Systemtic Name: 4-azanyl-3-bromanyl-5-methoxycarbonyl-benzoic acid Openeye Name: 4-amino-3-bromo-5-methoxycarbonyl-benzoic acid CAS Name: 4-amino-3-bromo-5-methoxycarbonylbenzoic acid IUPAC Name: 4-amino-3-bromo-5-methoxycarbonylbenzoic acid Traditional Name: 4-amino-3-bromo-5-carbomethoxy-benzoic acid Formula: C9H8BrNO4 MolecularWeight: 274.06812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC(=C1)C(=O)O)Br)N

Isomeric SMILES

COC(=O)C1=C(C(=CC(=C1)C(=O)O)Br)N

InChI

InChI=1S/C9H8BrNO4/c1-15-9(14)5-2-4(8(12)13)3-6(10)7(5)11/h2-3H,11H2,1H3,(H,12,13)