2-[[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 2-[[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 2-[[2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[2-(2-bromo-4-methylanilino)-2-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(2-bromo-4-methylanilino)-2-oxoethyl]amino]propanoic acid Traditional Name: 2-[[2-(2-bromo-4-methyl-anilino)-2-keto-ethyl]amino]propionic acid Formula: C12H15BrN2O3 MolecularWeight: 315.1631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CNC(C)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CNC(C)C(=O)O)Br

InChI

InChI=1S/C12H15BrN2O3/c1-7-3-4-10(9(13)5-7)15-11(16)6-14-8(2)12(17)18/h3-5,8,14H,6H2,1-2H3,(H,15,16)(H,17,18)