2-[(6-bromanyl-2H-chromen-3-yl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(6-bromanyl-2H-chromen-3-yl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(6-bromo-2H-chromene-3-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[[(6-bromo-2H-1-benzopyran-3-yl)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(6-bromo-2H-chromene-3-carbonyl)-methylamino]acetic acid Traditional Name: 2-[(6-bromo-2H-chromene-3-carbonyl)-methyl-amino]acetic acid Formula: C13H12BrNO4 MolecularWeight: 326.14268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC2=C(C=CC(=C2)Br)OC1

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC2=C(C=CC(=C2)Br)OC1

InChI

InChI=1S/C13H12BrNO4/c1-15(6-12(16)17)13(18)9-4-8-5-10(14)2-3-11(8)19-7-9/h2-5H,6-7H2,1H3,(H,16,17)