2-[(3-bromanyl-4-fluoranyl-phenyl)methyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(3-bromanyl-4-fluoranyl-phenyl)methyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[(3-bromo-4-fluoro-phenyl)methyl-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[(3-bromo-4-fluorophenyl)methyl-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[(3-bromo-4-fluorophenyl)methyl-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[(3-bromo-4-fluoro-benzyl)-(cyclopropylmethyl)amino]acetic acid Formula: C13H15BrFNO2 MolecularWeight: 316.166103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC2=CC(=C(C=C2)F)Br)CC(=O)O

Isomeric SMILES

C1CC1CN(CC2=CC(=C(C=C2)F)Br)CC(=O)O

InChI

InChI=1S/C13H15BrFNO2/c14-11-5-10(3-4-12(11)15)7-16(8-13(17)18)6-9-1-2-9/h3-5,9H,1-2,6-8H2,(H,17,18)