[3,5-bis(bromanyl)phenyl] 2-(2-azanylethanoylamino)-2-methyl-butanoate

Systemtic Name: [3,5-bis(bromanyl)phenyl] 2-(2-azanylethanoylamino)-2-methyl-butanoate Openeye Name: (3,5-dibromophenyl) 2-[(2-aminoacetyl)amino]-2-methyl-butanoate CAS Name: 2-[(2-amino-1-oxoethyl)amino]-2-methylbutanoic acid (3,5-dibromophenyl) ester IUPAC Name: (3,5-dibromophenyl) 2-[(2-aminoacetyl)amino]-2-methylbutanoate Traditional Name: 2-(glycylamino)-2-methyl-butyric acid (3,5-dibromophenyl) ester Formula: C13H16Br2N2O3 MolecularWeight: 408.08574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OC1=CC(=CC(=C1)Br)Br)NC(=O)CN

Isomeric SMILES

CCC(C)(C(=O)OC1=CC(=CC(=C1)Br)Br)NC(=O)CN

InChI

InChI=1S/C13H16Br2N2O3/c1-3-13(2,17-11(18)7-16)12(19)20-10-5-8(14)4-9(15)6-10/h4-6H,3,7,16H2,1-2H3,(H,17,18)