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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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