methyl 6-[2-[(3-bromophenyl)carbonylamino]ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-[(3-bromophenyl)carbonylamino]ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-[(3-bromobenzoyl)amino]acetyl]amino]hexanoate CAS Name: 6-[[2-[[(3-bromophenyl)-oxomethyl]amino]-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-[(3-bromobenzoyl)amino]acetyl]amino]hexanoate Traditional Name: 6-[[2-[(3-bromobenzoyl)amino]acetyl]amino]hexanoic acid methyl ester Formula: C16H21BrN2O4 MolecularWeight: 385.25294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CNC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)CNC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C16H21BrN2O4/c1-23-15(21)8-3-2-4-9-18-14(20)11-19-16(22)12-6-5-7-13(17)10-12/h5-7,10H,2-4,8-9,11H2,1H3,(H,18,20)(H,19,22)