2-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]acetic acid CAS Name: 2-[[(5-bromo-3-methyl-2-benzofuranyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)amino]acetic acid Traditional Name: 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]acetic acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NCC(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NCC(=O)O

InChI

InChI=1S/C12H10BrNO4/c1-6-8-4-7(13)2-3-9(8)18-11(6)12(17)14-5-10(15)16/h2-4H,5H2,1H3,(H,14,17)(H,15,16)