3-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]propanoate

Systemtic Name: 3-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]propanoate Openeye Name: 3-(2,6-dibromo-4-methyl-anilino)propanoate CAS Name: 3-(2,6-dibromo-4-methylanilino)propanoate IUPAC Name: 3-(2,6-dibromo-4-methylanilino)propanoate Traditional Name: 3-(2,6-dibromo-4-methyl-anilino)propionate Formula: C10H10Br2NO2- MolecularWeight: 335.9999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NCCC(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NCCC(=O)[O-])Br

InChI

InChI=1S/C10H11Br2NO2/c1-6-4-7(11)10(8(12)5-6)13-3-2-9(14)15/h4-5,13H,2-3H2,1H3,(H,14,15)/p-1