4-[[2,6-bis(bromanyl)-4-methyl-phenyl]carbamoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[[2,6-bis(bromanyl)-4-methyl-phenyl]carbamoyl-methyl-amino]butanoic acid Openeye Name: 4-[(2,6-dibromo-4-methyl-phenyl)carbamoyl-methyl-amino]butanoic acid CAS Name: 4-[[(2,6-dibromo-4-methylanilino)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(2,6-dibromo-4-methylphenyl)carbamoyl-methylamino]butanoic acid Traditional Name: 4-[(2,6-dibromo-4-methyl-phenyl)carbamoyl-methyl-amino]butyric acid Formula: C13H16Br2N2O3 MolecularWeight: 408.08574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)N(C)CCCC(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)N(C)CCCC(=O)O)Br

InChI

InChI=1S/C13H16Br2N2O3/c1-8-6-9(14)12(10(15)7-8)16-13(20)17(2)5-3-4-11(18)19/h6-7H,3-5H2,1-2H3,(H,16,20)(H,18,19)