2-[[5-(4-bromophenyl)furan-2-yl]methylamino]ethanoic acid

Systemtic Name: 2-[[5-(4-bromophenyl)furan-2-yl]methylamino]ethanoic acid Openeye Name: 2-[[5-(4-bromophenyl)-2-furyl]methylamino]acetic acid CAS Name: 2-[[5-(4-bromophenyl)-2-furanyl]methylamino]acetic acid IUPAC Name: 2-[[5-(4-bromophenyl)furan-2-yl]methylamino]acetic acid Traditional Name: 2-[[5-(4-bromophenyl)-2-furyl]methylamino]acetic acid Formula: C13H12BrNO3 MolecularWeight: 310.14328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)CNCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)CNCC(=O)O)Br

InChI

InChI=1S/C13H12BrNO3/c14-10-3-1-9(2-4-10)12-6-5-11(18-12)7-15-8-13(16)17/h1-6,15H,7-8H2,(H,16,17)