4-[2-(4-bromophenyl)ethanoylamino]butanoate

Systemtic Name: 4-[2-(4-bromophenyl)ethanoylamino]butanoate Openeye Name: 4-[[2-(4-bromophenyl)acetyl]amino]butanoate CAS Name: 4-[[2-(4-bromophenyl)-1-oxoethyl]amino]butanoate IUPAC Name: 4-[[2-(4-bromophenyl)acetyl]amino]butanoate Traditional Name: 4-[[2-(4-bromophenyl)acetyl]amino]butyrate Formula: C12H13BrNO3- MolecularWeight: 299.14052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NCCCC(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NCCCC(=O)[O-])Br

InChI

InChI=1S/C12H14BrNO3/c13-10-5-3-9(4-6-10)8-11(15)14-7-1-2-12(16)17/h3-6H,1-2,7-8H2,(H,14,15)(H,16,17)/p-1